USER MOD reduce.3.24.130724 H: found=0, std=0, add=857, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 854 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 80 THR OG1 : rot 150:sc= -6.84! USER MOD Set 1.2: A 87 ASN : amide:sc= -3.48 K(o=-10,f=-23!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -136:sc= -0.0985 (180deg=-0.881) USER MOD Single : A 6 ASN : amide:sc= -0.246 X(o=-0.25,f=-0.29) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 MET CE :methyl -160:sc= -0.0329 (180deg=-0.708) USER MOD Single : A 25 THR OG1 : rot -170:sc= -1.94 USER MOD Single : A 26 SER OG : rot 180:sc= -0.111 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 63:sc= -0.184 USER MOD Single : A 31 SER OG : rot 175:sc= -1.33 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 30:sc= 0.00815 USER MOD Single : A 48 ASN : amide:sc=-0.00131 X(o=-0.0013,f=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0.133 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 39:sc= 0.967 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.0655 K(o=-0.065,f=-1.2) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.0631 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 CYS SG : rot 63:sc= -0.6 USER MOD Single : A 102 HIS : no HD1:sc= -0.0206 X(o=-0.021,f=-0.44) USER MOD Single : A 114 ASN : amide:sc= -0.0943 K(o=-0.094,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 81.967 -82.287 -1.287 1.00 11.24 N ATOM 2 CA MET A 1 81.551 -81.800 0.023 1.00 64.32 C ATOM 3 C MET A 1 81.332 -80.290 -0.003 1.00 31.34 C ATOM 4 O MET A 1 81.636 -79.627 -0.993 1.00 2.13 O ATOM 5 CB MET A 1 82.599 -82.157 1.079 1.00 23.43 C ATOM 6 CG MET A 1 82.902 -83.645 1.157 1.00 5.30 C ATOM 7 SD MET A 1 81.645 -84.562 2.068 1.00 44.15 S ATOM 8 CE MET A 1 82.516 -86.092 2.396 1.00 53.54 C ATOM 0 H1 MET A 1 81.446 -83.157 -1.515 1.00 11.24 H new ATOM 0 H2 MET A 1 81.765 -81.564 -2.006 1.00 11.24 H new ATOM 0 H3 MET A 1 82.987 -82.488 -1.275 1.00 11.24 H new ATOM 0 HA MET A 1 80.608 -82.282 0.280 1.00 64.32 H new ATOM 0 HB2 MET A 1 83.521 -81.618 0.861 1.00 23.43 H new ATOM 0 HB3 MET A 1 82.252 -81.814 2.054 1.00 23.43 H new ATOM 0 HG2 MET A 1 82.981 -84.049 0.148 1.00 5.30 H new ATOM 0 HG3 MET A 1 83.871 -83.790 1.636 1.00 5.30 H new ATOM 0 HE1 MET A 1 81.868 -86.767 2.955 1.00 53.54 H new ATOM 0 HE2 MET A 1 82.799 -86.559 1.453 1.00 53.54 H new ATOM 0 HE3 MET A 1 83.412 -85.883 2.980 1.00 53.54 H new ATOM 18 N ALA A 2 80.804 -79.754 1.093 1.00 54.31 N ATOM 19 CA ALA A 2 80.546 -78.324 1.196 1.00 21.12 C ATOM 20 C ALA A 2 80.134 -77.941 2.614 1.00 33.12 C ATOM 21 O ALA A 2 79.944 -78.805 3.470 1.00 3.21 O ATOM 22 CB ALA A 2 79.472 -77.909 0.202 1.00 4.11 C ATOM 0 H ALA A 2 80.547 -80.290 1.922 1.00 54.31 H new ATOM 0 HA ALA A 2 81.469 -77.795 0.959 1.00 21.12 H new ATOM 0 HB1 ALA A 2 79.289 -76.838 0.290 1.00 4.11 H new ATOM 0 HB2 ALA A 2 79.805 -78.138 -0.810 1.00 4.11 H new ATOM 0 HB3 ALA A 2 78.551 -78.453 0.413 1.00 4.11 H new ATOM 28 N ASP A 3 80.000 -76.642 2.855 1.00 3.35 N ATOM 29 CA ASP A 3 79.610 -76.144 4.170 1.00 54.45 C ATOM 30 C ASP A 3 79.083 -74.716 4.075 1.00 30.14 C ATOM 31 O ASP A 3 79.030 -74.133 2.993 1.00 63.42 O ATOM 32 CB ASP A 3 80.797 -76.201 5.133 1.00 44.33 C ATOM 33 CG ASP A 3 82.038 -75.545 4.559 1.00 32.54 C ATOM 34 OD1 ASP A 3 82.786 -76.227 3.829 1.00 64.25 O ATOM 35 OD2 ASP A 3 82.261 -74.349 4.843 1.00 72.32 O ATOM 0 H ASP A 3 80.155 -75.914 2.158 1.00 3.35 H new ATOM 0 HA ASP A 3 78.812 -76.782 4.552 1.00 54.45 H new ATOM 0 HB2 ASP A 3 80.528 -75.708 6.067 1.00 44.33 H new ATOM 0 HB3 ASP A 3 81.017 -77.241 5.373 1.00 44.33 H new ATOM 40 N PHE A 4 78.693 -74.158 5.217 1.00 62.13 N ATOM 41 CA PHE A 4 78.168 -72.799 5.263 1.00 22.04 C ATOM 42 C PHE A 4 77.930 -72.357 6.704 1.00 22.33 C ATOM 43 O PHE A 4 77.753 -73.185 7.598 1.00 33.34 O ATOM 44 CB PHE A 4 76.864 -72.706 4.469 1.00 3.40 C ATOM 45 CG PHE A 4 75.748 -73.526 5.048 1.00 35.34 C ATOM 46 CD1 PHE A 4 75.609 -74.865 4.716 1.00 62.40 C ATOM 47 CD2 PHE A 4 74.837 -72.960 5.925 1.00 10.45 C ATOM 48 CE1 PHE A 4 74.583 -75.622 5.248 1.00 75.24 C ATOM 49 CE2 PHE A 4 73.809 -73.713 6.461 1.00 71.05 C ATOM 50 CZ PHE A 4 73.682 -75.046 6.122 1.00 45.43 C ATOM 0 H PHE A 4 78.731 -74.626 6.122 1.00 62.13 H new ATOM 0 HA PHE A 4 78.907 -72.136 4.814 1.00 22.04 H new ATOM 0 HB2 PHE A 4 76.551 -71.663 4.422 1.00 3.40 H new ATOM 0 HB3 PHE A 4 77.048 -73.030 3.445 1.00 3.40 H new ATOM 0 HD1 PHE A 4 76.311 -75.321 4.034 1.00 62.40 H new ATOM 0 HD2 PHE A 4 74.931 -71.918 6.193 1.00 10.45 H new ATOM 0 HE1 PHE A 4 74.486 -76.664 4.981 1.00 75.24 H new ATOM 0 HE2 PHE A 4 73.106 -73.260 7.144 1.00 71.05 H new ATOM 0 HZ PHE A 4 72.880 -75.637 6.539 1.00 45.43 H new ATOM 60 N ASP A 5 77.928 -71.046 6.922 1.00 52.13 N ATOM 61 CA ASP A 5 77.712 -70.492 8.253 1.00 74.43 C ATOM 62 C ASP A 5 76.885 -69.213 8.182 1.00 10.11 C ATOM 63 O ASP A 5 76.898 -68.509 7.174 1.00 65.42 O ATOM 64 CB ASP A 5 79.052 -70.211 8.936 1.00 52.22 C ATOM 65 CG ASP A 5 79.622 -71.438 9.620 1.00 64.02 C ATOM 66 OD1 ASP A 5 79.139 -71.785 10.718 1.00 63.03 O ATOM 67 OD2 ASP A 5 80.551 -72.052 9.056 1.00 63.44 O ATOM 0 H ASP A 5 78.074 -70.347 6.193 1.00 52.13 H new ATOM 0 HA ASP A 5 77.161 -71.227 8.840 1.00 74.43 H new ATOM 0 HB2 ASP A 5 79.765 -69.847 8.196 1.00 52.22 H new ATOM 0 HB3 ASP A 5 78.922 -69.416 9.671 1.00 52.22 H new ATOM 72 N ASN A 6 76.165 -68.918 9.260 1.00 72.12 N ATOM 73 CA ASN A 6 75.330 -67.724 9.319 1.00 52.21 C ATOM 74 C ASN A 6 75.448 -67.045 10.680 1.00 21.12 C ATOM 75 O ASN A 6 74.998 -67.580 11.694 1.00 63.11 O ATOM 76 CB ASN A 6 73.869 -68.084 9.041 1.00 4.31 C ATOM 77 CG ASN A 6 73.411 -69.295 9.831 1.00 63.23 C ATOM 78 OD1 ASN A 6 73.689 -70.435 9.457 1.00 10.23 O ATOM 79 ND2 ASN A 6 72.706 -69.053 10.929 1.00 21.51 N ATOM 0 H ASN A 6 76.143 -69.490 10.104 1.00 72.12 H new ATOM 0 HA ASN A 6 75.678 -67.029 8.555 1.00 52.21 H new ATOM 0 HB2 ASN A 6 73.235 -67.232 9.287 1.00 4.31 H new ATOM 0 HB3 ASN A 6 73.742 -68.279 7.976 1.00 4.31 H new ATOM 0 HD21 ASN A 6 72.371 -69.828 11.501 1.00 21.51 H new ATOM 0 HD22 ASN A 6 72.499 -68.092 11.201 1.00 21.51 H new ATOM 86 N LEU A 7 76.054 -65.864 10.693 1.00 24.44 N ATOM 87 CA LEU A 7 76.232 -65.109 11.930 1.00 4.34 C ATOM 88 C LEU A 7 74.908 -64.968 12.675 1.00 22.32 C ATOM 89 O LEU A 7 73.837 -65.174 12.105 1.00 21.01 O ATOM 90 CB LEU A 7 76.811 -63.725 11.628 1.00 11.43 C ATOM 91 CG LEU A 7 78.334 -63.644 11.518 1.00 13.55 C ATOM 92 CD1 LEU A 7 78.973 -63.733 12.895 1.00 12.24 C ATOM 93 CD2 LEU A 7 78.862 -64.744 10.611 1.00 53.25 C ATOM 0 H LEU A 7 76.431 -65.408 9.862 1.00 24.44 H new ATOM 0 HA LEU A 7 76.929 -65.656 12.564 1.00 4.34 H new ATOM 0 HB2 LEU A 7 76.380 -63.369 10.692 1.00 11.43 H new ATOM 0 HB3 LEU A 7 76.486 -63.039 12.410 1.00 11.43 H new ATOM 0 HG LEU A 7 78.597 -62.682 11.079 1.00 13.55 H new ATOM 0 HD11 LEU A 7 80.057 -63.674 12.798 1.00 12.24 H new ATOM 0 HD12 LEU A 7 78.619 -62.909 13.514 1.00 12.24 H new ATOM 0 HD13 LEU A 7 78.702 -64.680 13.361 1.00 12.24 H new ATOM 0 HD21 LEU A 7 79.948 -64.671 10.544 1.00 53.25 H new ATOM 0 HD22 LEU A 7 78.588 -65.716 11.021 1.00 53.25 H new ATOM 0 HD23 LEU A 7 78.429 -64.635 9.617 1.00 53.25 H new ATOM 105 N PHE A 8 74.990 -64.612 13.954 1.00 62.42 N ATOM 106 CA PHE A 8 73.800 -64.442 14.778 1.00 45.32 C ATOM 107 C PHE A 8 73.784 -63.064 15.432 1.00 1.11 C ATOM 108 O PHE A 8 74.639 -62.747 16.260 1.00 53.22 O ATOM 109 CB PHE A 8 73.737 -65.530 15.852 1.00 31.41 C ATOM 110 CG PHE A 8 73.797 -66.924 15.298 1.00 14.11 C ATOM 111 CD1 PHE A 8 75.013 -67.563 15.122 1.00 43.32 C ATOM 112 CD2 PHE A 8 72.636 -67.596 14.952 1.00 12.43 C ATOM 113 CE1 PHE A 8 75.071 -68.847 14.612 1.00 4.32 C ATOM 114 CE2 PHE A 8 72.687 -68.879 14.442 1.00 13.25 C ATOM 115 CZ PHE A 8 73.906 -69.504 14.271 1.00 54.55 C ATOM 0 H PHE A 8 75.869 -64.436 14.441 1.00 62.42 H new ATOM 0 HA PHE A 8 72.926 -64.528 14.132 1.00 45.32 H new ATOM 0 HB2 PHE A 8 74.563 -65.389 16.549 1.00 31.41 H new ATOM 0 HB3 PHE A 8 72.815 -65.414 16.422 1.00 31.41 H new ATOM 0 HD1 PHE A 8 75.927 -67.052 15.386 1.00 43.32 H new ATOM 0 HD2 PHE A 8 71.680 -67.111 15.082 1.00 12.43 H new ATOM 0 HE1 PHE A 8 76.026 -69.335 14.481 1.00 4.32 H new ATOM 0 HE2 PHE A 8 71.774 -69.392 14.177 1.00 13.25 H new ATOM 0 HZ PHE A 8 73.948 -70.506 13.871 1.00 54.55 H new ATOM 125 N ASP A 9 72.806 -62.247 15.054 1.00 21.42 N ATOM 126 CA ASP A 9 72.678 -60.903 15.604 1.00 2.33 C ATOM 127 C ASP A 9 72.224 -60.952 17.060 1.00 44.04 C ATOM 128 O ASP A 9 71.037 -60.819 17.355 1.00 10.41 O ATOM 129 CB ASP A 9 71.688 -60.082 14.775 1.00 54.03 C ATOM 130 CG ASP A 9 71.915 -60.236 13.284 1.00 14.05 C ATOM 131 OD1 ASP A 9 72.915 -59.688 12.777 1.00 60.51 O ATOM 132 OD2 ASP A 9 71.090 -60.903 12.624 1.00 51.41 O ATOM 0 H ASP A 9 72.091 -62.492 14.369 1.00 21.42 H new ATOM 0 HA ASP A 9 73.657 -60.426 15.564 1.00 2.33 H new ATOM 0 HB2 ASP A 9 70.671 -60.390 15.019 1.00 54.03 H new ATOM 0 HB3 ASP A 9 71.776 -59.030 15.046 1.00 54.03 H new ATOM 137 N ALA A 10 73.179 -61.143 17.965 1.00 15.34 N ATOM 138 CA ALA A 10 72.876 -61.209 19.389 1.00 72.43 C ATOM 139 C ALA A 10 73.509 -60.041 20.139 1.00 71.02 C ATOM 140 O ALA A 10 74.571 -59.549 19.757 1.00 24.13 O ATOM 141 CB ALA A 10 73.355 -62.532 19.969 1.00 21.24 C ATOM 0 H ALA A 10 74.167 -61.254 17.737 1.00 15.34 H new ATOM 0 HA ALA A 10 71.795 -61.142 19.509 1.00 72.43 H new ATOM 0 HB1 ALA A 10 73.122 -62.568 21.033 1.00 21.24 H new ATOM 0 HB2 ALA A 10 72.854 -63.355 19.460 1.00 21.24 H new ATOM 0 HB3 ALA A 10 74.432 -62.621 19.830 1.00 21.24 H new ATOM 147 N ALA A 11 72.850 -59.601 21.205 1.00 12.10 N ATOM 148 CA ALA A 11 73.349 -58.492 22.009 1.00 12.41 C ATOM 149 C ALA A 11 74.449 -58.953 22.959 1.00 13.52 C ATOM 150 O ALA A 11 74.174 -59.591 23.977 1.00 62.23 O ATOM 151 CB ALA A 11 72.210 -57.851 22.787 1.00 4.32 C ATOM 0 H ALA A 11 71.968 -59.996 21.533 1.00 12.10 H new ATOM 0 HA ALA A 11 73.777 -57.750 21.335 1.00 12.41 H new ATOM 0 HB1 ALA A 11 72.597 -57.024 23.383 1.00 4.32 H new ATOM 0 HB2 ALA A 11 71.459 -57.477 22.091 1.00 4.32 H new ATOM 0 HB3 ALA A 11 71.757 -58.592 23.445 1.00 4.32 H new ATOM 157 N ILE A 12 75.691 -58.627 22.621 1.00 61.33 N ATOM 158 CA ILE A 12 76.831 -59.008 23.446 1.00 11.02 C ATOM 159 C ILE A 12 77.650 -57.787 23.851 1.00 11.40 C ATOM 160 O ILE A 12 78.807 -57.646 23.458 1.00 22.42 O ATOM 161 CB ILE A 12 77.747 -60.006 22.713 1.00 34.12 C ATOM 162 CG1 ILE A 12 76.921 -61.149 22.119 1.00 14.35 C ATOM 163 CG2 ILE A 12 78.805 -60.548 23.662 1.00 71.51 C ATOM 164 CD1 ILE A 12 77.746 -62.152 21.344 1.00 62.32 C ATOM 0 H ILE A 12 75.934 -58.100 21.782 1.00 61.33 H new ATOM 0 HA ILE A 12 76.428 -59.485 24.340 1.00 11.02 H new ATOM 0 HB ILE A 12 78.250 -59.485 21.898 1.00 34.12 H new ATOM 0 HG12 ILE A 12 76.399 -61.665 22.924 1.00 14.35 H new ATOM 0 HG13 ILE A 12 76.159 -60.732 21.461 1.00 14.35 H new ATOM 0 HG21 ILE A 12 79.445 -61.252 23.130 1.00 71.51 H new ATOM 0 HG22 ILE A 12 79.409 -59.724 24.042 1.00 71.51 H new ATOM 0 HG23 ILE A 12 78.320 -61.057 24.495 1.00 71.51 H new ATOM 0 HD11 ILE A 12 77.095 -62.933 20.952 1.00 62.32 H new ATOM 0 HD12 ILE A 12 78.248 -61.649 20.517 1.00 62.32 H new ATOM 0 HD13 ILE A 12 78.491 -62.597 22.003 1.00 62.32 H new ATOM 176 N ALA A 13 77.041 -56.908 24.639 1.00 54.32 N ATOM 177 CA ALA A 13 77.714 -55.700 25.101 1.00 53.13 C ATOM 178 C ALA A 13 76.881 -54.976 26.153 1.00 34.44 C ATOM 179 O ALA A 13 75.720 -54.642 25.919 1.00 43.55 O ATOM 180 CB ALA A 13 78.004 -54.777 23.927 1.00 64.31 C ATOM 0 H ALA A 13 76.082 -57.010 24.971 1.00 54.32 H new ATOM 0 HA ALA A 13 78.658 -55.992 25.561 1.00 53.13 H new ATOM 0 HB1 ALA A 13 78.507 -53.879 24.286 1.00 64.31 H new ATOM 0 HB2 ALA A 13 78.645 -55.290 23.211 1.00 64.31 H new ATOM 0 HB3 ALA A 13 77.068 -54.500 23.442 1.00 64.31 H new ATOM 186 N ARG A 14 77.483 -54.737 27.315 1.00 11.41 N ATOM 187 CA ARG A 14 76.795 -54.055 28.403 1.00 24.55 C ATOM 188 C ARG A 14 77.056 -52.551 28.354 1.00 70.13 C ATOM 189 O ARG A 14 77.630 -51.980 29.279 1.00 24.42 O ATOM 190 CB ARG A 14 77.248 -54.616 29.752 1.00 34.31 C ATOM 191 CG ARG A 14 76.479 -55.853 30.186 1.00 51.01 C ATOM 192 CD ARG A 14 76.859 -57.066 29.350 1.00 50.40 C ATOM 193 NE ARG A 14 76.072 -58.243 29.705 1.00 72.21 N ATOM 194 CZ ARG A 14 76.249 -59.439 29.153 1.00 32.15 C ATOM 195 NH1 ARG A 14 77.181 -59.615 28.227 1.00 2.34 N ATOM 196 NH2 ARG A 14 75.492 -60.463 29.529 1.00 63.53 N ATOM 0 H ARG A 14 78.444 -55.006 27.526 1.00 11.41 H new ATOM 0 HA ARG A 14 75.725 -54.226 28.286 1.00 24.55 H new ATOM 0 HB2 ARG A 14 78.309 -54.859 29.697 1.00 34.31 H new ATOM 0 HB3 ARG A 14 77.137 -53.844 30.513 1.00 34.31 H new ATOM 0 HG2 ARG A 14 76.679 -56.057 31.238 1.00 51.01 H new ATOM 0 HG3 ARG A 14 75.409 -55.668 30.096 1.00 51.01 H new ATOM 0 HD2 ARG A 14 76.714 -56.838 28.294 1.00 50.40 H new ATOM 0 HD3 ARG A 14 77.918 -57.283 29.487 1.00 50.40 H new ATOM 0 HE ARG A 14 75.347 -58.142 30.415 1.00 72.21 H new ATOM 0 HH11 ARG A 14 77.765 -58.831 27.936 1.00 2.34 H new ATOM 0 HH12 ARG A 14 77.314 -60.534 27.806 1.00 2.34 H new ATOM 0 HH21 ARG A 14 74.774 -60.332 30.242 1.00 63.53 H new ATOM 0 HH22 ARG A 14 75.628 -61.381 29.105 1.00 63.53 H new ATOM 210 N ALA A 15 76.629 -51.918 27.265 1.00 63.34 N ATOM 211 CA ALA A 15 76.816 -50.483 27.095 1.00 3.25 C ATOM 212 C ALA A 15 75.538 -49.819 26.590 1.00 71.34 C ATOM 213 O ALA A 15 74.505 -50.473 26.444 1.00 21.32 O ATOM 214 CB ALA A 15 77.967 -50.209 26.138 1.00 31.30 C ATOM 0 H ALA A 15 76.152 -52.377 26.489 1.00 63.34 H new ATOM 0 HA ALA A 15 77.058 -50.056 28.068 1.00 3.25 H new ATOM 0 HB1 ALA A 15 78.095 -49.133 26.021 1.00 31.30 H new ATOM 0 HB2 ALA A 15 78.884 -50.642 26.538 1.00 31.30 H new ATOM 0 HB3 ALA A 15 77.748 -50.656 25.168 1.00 31.30 H new ATOM 220 N ASP A 16 75.617 -48.520 26.327 1.00 12.34 N ATOM 221 CA ASP A 16 74.466 -47.768 25.838 1.00 15.25 C ATOM 222 C ASP A 16 74.601 -47.476 24.347 1.00 72.14 C ATOM 223 O ASP A 16 75.471 -46.711 23.932 1.00 62.24 O ATOM 224 CB ASP A 16 74.317 -46.460 26.616 1.00 51.01 C ATOM 225 CG ASP A 16 75.561 -45.596 26.540 1.00 11.21 C ATOM 226 OD1 ASP A 16 76.626 -46.050 27.006 1.00 20.11 O ATOM 227 OD2 ASP A 16 75.468 -44.467 26.015 1.00 24.02 O ATOM 0 H ASP A 16 76.465 -47.965 26.444 1.00 12.34 H new ATOM 0 HA ASP A 16 73.574 -48.376 25.991 1.00 15.25 H new ATOM 0 HB2 ASP A 16 73.466 -45.902 26.224 1.00 51.01 H new ATOM 0 HB3 ASP A 16 74.097 -46.684 27.660 1.00 51.01 H new ATOM 232 N GLU A 17 73.736 -48.091 23.548 1.00 2.40 N ATOM 233 CA GLU A 17 73.760 -47.897 22.103 1.00 44.02 C ATOM 234 C GLU A 17 72.354 -47.656 21.561 1.00 71.52 C ATOM 235 O GLU A 17 71.361 -48.016 22.197 1.00 43.25 O ATOM 236 CB GLU A 17 74.383 -49.113 21.414 1.00 44.11 C ATOM 237 CG GLU A 17 73.942 -50.440 22.006 1.00 13.32 C ATOM 238 CD GLU A 17 74.586 -51.629 21.320 1.00 51.03 C ATOM 239 OE1 GLU A 17 75.834 -51.692 21.287 1.00 2.52 O ATOM 240 OE2 GLU A 17 73.843 -52.496 20.814 1.00 75.42 O ATOM 0 H GLU A 17 73.010 -48.728 23.876 1.00 2.40 H new ATOM 0 HA GLU A 17 74.367 -47.017 21.891 1.00 44.02 H new ATOM 0 HB2 GLU A 17 74.123 -49.093 20.356 1.00 44.11 H new ATOM 0 HB3 GLU A 17 75.469 -49.039 21.477 1.00 44.11 H new ATOM 0 HG2 GLU A 17 74.190 -50.460 23.067 1.00 13.32 H new ATOM 0 HG3 GLU A 17 72.858 -50.525 21.930 1.00 13.32 H new ATOM 247 N THR A 18 72.276 -47.045 20.383 1.00 34.40 N ATOM 248 CA THR A 18 70.993 -46.754 19.756 1.00 33.01 C ATOM 249 C THR A 18 71.141 -46.596 18.248 1.00 71.04 C ATOM 250 O THR A 18 72.253 -46.606 17.720 1.00 61.43 O ATOM 251 CB THR A 18 70.362 -45.474 20.336 1.00 50.13 C ATOM 252 OG1 THR A 18 71.339 -44.741 21.083 1.00 73.10 O ATOM 253 CG2 THR A 18 69.179 -45.811 21.230 1.00 24.33 C ATOM 0 H THR A 18 73.087 -46.742 19.844 1.00 34.40 H new ATOM 0 HA THR A 18 70.339 -47.600 19.967 1.00 33.01 H new ATOM 0 HB THR A 18 70.007 -44.862 19.507 1.00 50.13 H new ATOM 0 HG1 THR A 18 70.930 -43.928 21.447 1.00 73.10 H new ATOM 0 HG21 THR A 18 68.750 -44.891 21.628 1.00 24.33 H new ATOM 0 HG22 THR A 18 68.424 -46.342 20.650 1.00 24.33 H new ATOM 0 HG23 THR A 18 69.514 -46.441 22.054 1.00 24.33 H new ATOM 261 N ILE A 19 70.014 -46.451 17.559 1.00 13.10 N ATOM 262 CA ILE A 19 70.020 -46.289 16.110 1.00 33.40 C ATOM 263 C ILE A 19 69.092 -45.159 15.680 1.00 24.13 C ATOM 264 O ILE A 19 67.870 -45.278 15.765 1.00 2.10 O ATOM 265 CB ILE A 19 69.595 -47.587 15.398 1.00 40.43 C ATOM 266 CG1 ILE A 19 69.455 -47.346 13.893 1.00 65.53 C ATOM 267 CG2 ILE A 19 68.289 -48.107 15.979 1.00 15.11 C ATOM 268 CD1 ILE A 19 69.158 -48.601 13.105 1.00 53.43 C ATOM 0 H ILE A 19 69.085 -46.442 17.981 1.00 13.10 H new ATOM 0 HA ILE A 19 71.043 -46.045 15.823 1.00 33.40 H new ATOM 0 HB ILE A 19 70.367 -48.340 15.557 1.00 40.43 H new ATOM 0 HG12 ILE A 19 68.658 -46.622 13.722 1.00 65.53 H new ATOM 0 HG13 ILE A 19 70.376 -46.901 13.517 1.00 65.53 H new ATOM 0 HG21 ILE A 19 68.002 -49.025 15.465 1.00 15.11 H new ATOM 0 HG22 ILE A 19 68.419 -48.312 17.042 1.00 15.11 H new ATOM 0 HG23 ILE A 19 67.508 -47.358 15.847 1.00 15.11 H new ATOM 0 HD11 ILE A 19 69.072 -48.354 12.047 1.00 53.43 H new ATOM 0 HD12 ILE A 19 69.966 -49.319 13.246 1.00 53.43 H new ATOM 0 HD13 ILE A 19 68.221 -49.036 13.453 1.00 53.43 H new ATOM 280 N ARG A 20 69.682 -44.062 15.215 1.00 3.04 N ATOM 281 CA ARG A 20 68.908 -42.909 14.771 1.00 2.55 C ATOM 282 C ARG A 20 68.707 -42.940 13.259 1.00 44.22 C ATOM 283 O ARG A 20 69.592 -43.356 12.513 1.00 55.52 O ATOM 284 CB ARG A 20 69.608 -41.611 15.176 1.00 25.10 C ATOM 285 CG ARG A 20 69.560 -41.334 16.670 1.00 4.44 C ATOM 286 CD ARG A 20 70.461 -40.169 17.050 1.00 41.33 C ATOM 287 NE ARG A 20 69.767 -38.887 16.954 1.00 70.32 N ATOM 288 CZ ARG A 20 70.352 -37.716 17.184 1.00 50.54 C ATOM 289 NH1 ARG A 20 71.633 -37.666 17.520 1.00 35.01 N ATOM 290 NH2 ARG A 20 69.654 -36.593 17.076 1.00 25.13 N ATOM 0 H ARG A 20 70.693 -43.948 15.136 1.00 3.04 H new ATOM 0 HA ARG A 20 67.931 -42.952 15.252 1.00 2.55 H new ATOM 0 HB2 ARG A 20 70.649 -41.655 14.856 1.00 25.10 H new ATOM 0 HB3 ARG A 20 69.146 -40.778 14.646 1.00 25.10 H new ATOM 0 HG2 ARG A 20 68.535 -41.115 16.968 1.00 4.44 H new ATOM 0 HG3 ARG A 20 69.867 -42.226 17.217 1.00 4.44 H new ATOM 0 HD2 ARG A 20 70.825 -40.309 18.068 1.00 41.33 H new ATOM 0 HD3 ARG A 20 71.334 -40.158 16.398 1.00 41.33 H new ATOM 0 HE ARG A 20 68.780 -38.891 16.697 1.00 70.32 H new ATOM 0 HH11 ARG A 20 72.173 -38.528 17.603 1.00 35.01 H new ATOM 0 HH12 ARG A 20 72.079 -36.766 17.696 1.00 35.01 H new ATOM 0 HH21 ARG A 20 68.668 -36.628 16.816 1.00 25.13 H new ATOM 0 HH22 ARG A 20 70.103 -35.694 17.253 1.00 25.13 H new ATOM 304 N GLY A 21 67.535 -42.496 12.813 1.00 45.32 N ATOM 305 CA GLY A 21 67.239 -42.482 11.391 1.00 35.15 C ATOM 306 C GLY A 21 65.753 -42.382 11.111 1.00 50.15 C ATOM 307 O GLY A 21 64.981 -43.261 11.494 1.00 12.22 O ATOM 0 H GLY A 21 66.786 -42.146 13.410 1.00 45.32 H new ATOM 0 HA2 GLY A 21 67.751 -41.641 10.924 1.00 35.15 H new ATOM 0 HA3 GLY A 21 67.632 -43.389 10.932 1.00 35.15 H new ATOM 311 N TYR A 22 65.350 -41.308 10.440 1.00 74.42 N ATOM 312 CA TYR A 22 63.946 -41.094 10.112 1.00 52.45 C ATOM 313 C TYR A 22 63.791 -40.616 8.671 1.00 54.13 C ATOM 314 O TYR A 22 63.039 -41.199 7.890 1.00 10.23 O ATOM 315 CB TYR A 22 63.326 -40.075 11.069 1.00 3.21 C ATOM 316 CG TYR A 22 61.848 -40.287 11.305 1.00 13.21 C ATOM 317 CD1 TYR A 22 60.965 -40.417 10.240 1.00 44.22 C ATOM 318 CD2 TYR A 22 61.334 -40.360 12.594 1.00 40.42 C ATOM 319 CE1 TYR A 22 59.614 -40.610 10.451 1.00 2.11 C ATOM 320 CE2 TYR A 22 59.985 -40.555 12.815 1.00 52.52 C ATOM 321 CZ TYR A 22 59.129 -40.679 11.740 1.00 30.04 C ATOM 322 OH TYR A 22 57.783 -40.873 11.955 1.00 12.31 O ATOM 0 H TYR A 22 65.976 -40.572 10.113 1.00 74.42 H new ATOM 0 HA TYR A 22 63.425 -42.045 10.219 1.00 52.45 H new ATOM 0 HB2 TYR A 22 63.848 -40.122 12.025 1.00 3.21 H new ATOM 0 HB3 TYR A 22 63.481 -39.073 10.670 1.00 3.21 H new ATOM 0 HD1 TYR A 22 61.342 -40.366 9.229 1.00 44.22 H new ATOM 0 HD2 TYR A 22 62.001 -40.263 13.438 1.00 40.42 H new ATOM 0 HE1 TYR A 22 58.941 -40.706 9.612 1.00 2.11 H new ATOM 0 HE2 TYR A 22 59.602 -40.610 13.823 1.00 52.52 H new ATOM 0 HH TYR A 22 57.606 -40.899 12.919 1.00 12.31 H new ATOM 332 N MET A 23 64.507 -39.551 8.327 1.00 73.32 N ATOM 333 CA MET A 23 64.451 -38.995 6.980 1.00 51.11 C ATOM 334 C MET A 23 65.339 -39.789 6.027 1.00 20.42 C ATOM 335 O MET A 23 64.864 -40.341 5.036 1.00 42.31 O ATOM 336 CB MET A 23 64.882 -37.527 6.993 1.00 32.33 C ATOM 337 CG MET A 23 64.530 -36.779 5.718 1.00 22.24 C ATOM 338 SD MET A 23 62.985 -35.859 5.856 1.00 65.31 S ATOM 339 CE MET A 23 61.813 -37.073 5.255 1.00 33.44 C ATOM 0 H MET A 23 65.133 -39.056 8.962 1.00 73.32 H new ATOM 0 HA MET A 23 63.421 -39.061 6.629 1.00 51.11 H new ATOM 0 HB2 MET A 23 64.412 -37.026 7.840 1.00 32.33 H new ATOM 0 HB3 MET A 23 65.959 -37.475 7.150 1.00 32.33 H new ATOM 0 HG2 MET A 23 65.338 -36.090 5.471 1.00 22.24 H new ATOM 0 HG3 MET A 23 64.453 -37.489 4.894 1.00 22.24 H new ATOM 0 HE1 MET A 23 60.897 -36.571 4.943 1.00 33.44 H new ATOM 0 HE2 MET A 23 62.243 -37.604 4.406 1.00 33.44 H new ATOM 0 HE3 MET A 23 61.585 -37.783 6.050 1.00 33.44 H new ATOM 349 N GLY A 24 66.632 -39.840 6.334 1.00 51.35 N ATOM 350 CA GLY A 24 67.565 -40.568 5.493 1.00 20.32 C ATOM 351 C GLY A 24 68.742 -39.717 5.062 1.00 44.33 C ATOM 352 O GLY A 24 69.769 -40.238 4.627 1.00 42.14 O ATOM 0 H GLY A 24 67.050 -39.391 7.149 1.00 51.35 H new ATOM 0 HA2 GLY A 24 67.931 -41.442 6.033 1.00 20.32 H new ATOM 0 HA3 GLY A 24 67.043 -40.935 4.609 1.00 20.32 H new ATOM 356 N THR A 25 68.594 -38.401 5.181 1.00 63.33 N ATOM 357 CA THR A 25 69.653 -37.475 4.797 1.00 41.43 C ATOM 358 C THR A 25 70.517 -37.101 5.995 1.00 31.03 C ATOM 359 O THR A 25 70.087 -36.352 6.873 1.00 74.32 O ATOM 360 CB THR A 25 69.077 -36.190 4.173 1.00 13.44 C ATOM 361 OG1 THR A 25 68.161 -35.570 5.085 1.00 53.15 O ATOM 362 CG2 THR A 25 68.366 -36.496 2.863 1.00 4.15 C ATOM 0 H THR A 25 67.751 -37.952 5.540 1.00 63.33 H new ATOM 0 HA THR A 25 70.266 -37.987 4.055 1.00 41.43 H new ATOM 0 HB THR A 25 69.904 -35.509 3.969 1.00 13.44 H new ATOM 0 HG1 THR A 25 67.682 -34.848 4.627 1.00 53.15 H new ATOM 0 HG21 THR A 25 67.968 -35.573 2.441 1.00 4.15 H new ATOM 0 HG22 THR A 25 69.072 -36.941 2.161 1.00 4.15 H new ATOM 0 HG23 THR A 25 67.549 -37.193 3.047 1.00 4.15 H new ATOM 370 N SER A 26 71.738 -37.625 6.025 1.00 52.23 N ATOM 371 CA SER A 26 72.662 -37.349 7.118 1.00 62.44 C ATOM 372 C SER A 26 73.285 -35.964 6.966 1.00 54.41 C ATOM 373 O SER A 26 73.925 -35.666 5.957 1.00 14.44 O ATOM 374 CB SER A 26 73.762 -38.412 7.167 1.00 13.20 C ATOM 375 OG SER A 26 75.017 -37.865 6.803 1.00 61.42 O ATOM 0 H SER A 26 72.110 -38.243 5.304 1.00 52.23 H new ATOM 0 HA SER A 26 72.099 -37.376 8.051 1.00 62.44 H new ATOM 0 HB2 SER A 26 73.822 -38.831 8.171 1.00 13.20 H new ATOM 0 HB3 SER A 26 73.510 -39.232 6.494 1.00 13.20 H new ATOM 0 HG SER A 26 75.703 -38.564 6.844 1.00 61.42 H new ATOM 381 N ALA A 27 73.093 -35.122 7.976 1.00 41.43 N ATOM 382 CA ALA A 27 73.637 -33.770 7.957 1.00 43.43 C ATOM 383 C ALA A 27 73.907 -33.266 9.371 1.00 43.22 C ATOM 384 O ALA A 27 73.375 -33.801 10.344 1.00 5.03 O ATOM 385 CB ALA A 27 72.685 -32.829 7.232 1.00 63.51 C ATOM 0 H ALA A 27 72.565 -35.352 8.818 1.00 41.43 H new ATOM 0 HA ALA A 27 74.586 -33.794 7.421 1.00 43.43 H new ATOM 0 HB1 ALA A 27 73.103 -31.823 7.225 1.00 63.51 H new ATOM 0 HB2 ALA A 27 72.546 -33.171 6.207 1.00 63.51 H new ATOM 0 HB3 ALA A 27 71.723 -32.819 7.745 1.00 63.51 H new ATOM 391 N THR A 28 74.738 -32.233 9.477 1.00 75.24 N ATOM 392 CA THR A 28 75.081 -31.659 10.772 1.00 12.44 C ATOM 393 C THR A 28 74.926 -30.143 10.759 1.00 14.21 C ATOM 394 O THR A 28 75.874 -29.415 10.463 1.00 13.54 O ATOM 395 CB THR A 28 76.523 -32.013 11.179 1.00 33.25 C ATOM 396 OG1 THR A 28 76.601 -33.391 11.563 1.00 10.21 O ATOM 397 CG2 THR A 28 76.992 -31.135 12.330 1.00 13.33 C ATOM 0 H THR A 28 75.185 -31.777 8.682 1.00 75.24 H new ATOM 0 HA THR A 28 74.391 -32.086 11.500 1.00 12.44 H new ATOM 0 HB THR A 28 77.171 -31.838 10.320 1.00 33.25 H new ATOM 0 HG1 THR A 28 77.522 -33.608 11.819 1.00 10.21 H new ATOM 0 HG21 THR A 28 78.013 -31.404 12.600 1.00 13.33 H new ATOM 0 HG22 THR A 28 76.960 -30.089 12.026 1.00 13.33 H new ATOM 0 HG23 THR A 28 76.339 -31.283 13.190 1.00 13.33 H new ATOM 405 N ILE A 29 73.725 -29.673 11.082 1.00 20.31 N ATOM 406 CA ILE A 29 73.448 -28.242 11.109 1.00 72.43 C ATOM 407 C ILE A 29 74.583 -27.475 11.778 1.00 22.52 C ATOM 408 O ILE A 29 75.005 -27.808 12.887 1.00 61.14 O ATOM 409 CB ILE A 29 72.131 -27.938 11.849 1.00 65.42 C ATOM 410 CG1 ILE A 29 71.913 -28.944 12.980 1.00 13.05 C ATOM 411 CG2 ILE A 29 70.961 -27.961 10.878 1.00 11.23 C ATOM 412 CD1 ILE A 29 70.703 -28.638 13.836 1.00 64.12 C ATOM 0 H ILE A 29 72.929 -30.262 11.328 1.00 20.31 H new ATOM 0 HA ILE A 29 73.356 -27.918 10.072 1.00 72.43 H new ATOM 0 HB ILE A 29 72.197 -26.941 12.284 1.00 65.42 H new ATOM 0 HG12 ILE A 29 71.803 -29.941 12.553 1.00 13.05 H new ATOM 0 HG13 ILE A 29 72.800 -28.965 13.613 1.00 13.05 H new ATOM 0 HG21 ILE A 29 70.038 -27.745 11.416 1.00 11.23 H new ATOM 0 HG22 ILE A 29 71.115 -27.209 10.104 1.00 11.23 H new ATOM 0 HG23 ILE A 29 70.890 -28.946 10.417 1.00 11.23 H new ATOM 0 HD11 ILE A 29 70.610 -29.392 14.618 1.00 64.12 H new ATOM 0 HD12 ILE A 29 70.819 -27.655 14.292 1.00 64.12 H new ATOM 0 HD13 ILE A 29 69.807 -28.646 13.216 1.00 64.12 H new ATOM 424 N THR A 30 75.073 -26.443 11.100 1.00 25.02 N ATOM 425 CA THR A 30 76.159 -25.626 11.628 1.00 42.23 C ATOM 426 C THR A 30 76.116 -24.215 11.052 1.00 20.01 C ATOM 427 O THR A 30 76.578 -23.975 9.937 1.00 43.44 O ATOM 428 CB THR A 30 77.532 -26.252 11.321 1.00 70.31 C ATOM 429 OG1 THR A 30 77.504 -27.656 11.600 1.00 31.44 O ATOM 430 CG2 THR A 30 78.626 -25.587 12.145 1.00 14.30 C ATOM 0 H THR A 30 74.735 -26.152 10.183 1.00 25.02 H new ATOM 0 HA THR A 30 76.023 -25.578 12.708 1.00 42.23 H new ATOM 0 HB THR A 30 77.750 -26.097 10.264 1.00 70.31 H new ATOM 0 HG1 THR A 30 76.859 -28.095 11.007 1.00 31.44 H new ATOM 0 HG21 THR A 30 79.587 -26.045 11.911 1.00 14.30 H new ATOM 0 HG22 THR A 30 78.664 -24.524 11.908 1.00 14.30 H new ATOM 0 HG23 THR A 30 78.411 -25.715 13.206 1.00 14.30 H new ATOM 438 N SER A 31 75.560 -23.284 11.820 1.00 2.11 N ATOM 439 CA SER A 31 75.454 -21.897 11.384 1.00 25.32 C ATOM 440 C SER A 31 75.725 -20.941 12.543 1.00 61.35 C ATOM 441 O SER A 31 74.811 -20.307 13.066 1.00 1.54 O ATOM 442 CB SER A 31 74.066 -21.627 10.800 1.00 62.43 C ATOM 443 OG SER A 31 74.010 -20.351 10.186 1.00 20.34 O ATOM 0 H SER A 31 75.176 -23.465 12.747 1.00 2.11 H new ATOM 0 HA SER A 31 76.204 -21.727 10.612 1.00 25.32 H new ATOM 0 HB2 SER A 31 73.820 -22.397 10.069 1.00 62.43 H new ATOM 0 HB3 SER A 31 73.318 -21.687 11.590 1.00 62.43 H new ATOM 0 HG SER A 31 73.140 -20.235 9.750 1.00 20.34 H new ATOM 449 N GLY A 32 76.991 -20.845 12.939 1.00 21.40 N ATOM 450 CA GLY A 32 77.361 -19.966 14.033 1.00 25.34 C ATOM 451 C GLY A 32 78.852 -19.974 14.305 1.00 70.14 C ATOM 452 O GLY A 32 79.575 -20.838 13.810 1.00 54.50 O ATOM 0 H GLY A 32 77.766 -21.360 12.522 1.00 21.40 H new ATOM 0 HA2 GLY A 32 77.043 -18.950 13.802 1.00 25.34 H new ATOM 0 HA3 GLY A 32 76.829 -20.269 14.935 1.00 25.34 H new ATOM 456 N GLU A 33 79.314 -19.007 15.091 1.00 31.53 N ATOM 457 CA GLU A 33 80.730 -18.906 15.425 1.00 74.11 C ATOM 458 C GLU A 33 81.276 -20.253 15.893 1.00 2.32 C ATOM 459 O GLU A 33 82.477 -20.508 15.810 1.00 74.00 O ATOM 460 CB GLU A 33 80.947 -17.850 16.512 1.00 40.43 C ATOM 461 CG GLU A 33 80.249 -18.172 17.822 1.00 52.44 C ATOM 462 CD GLU A 33 80.614 -17.205 18.931 1.00 53.30 C ATOM 463 OE1 GLU A 33 81.632 -17.442 19.613 1.00 62.25 O ATOM 464 OE2 GLU A 33 79.880 -16.212 19.116 1.00 63.31 O ATOM 0 H GLU A 33 78.729 -18.283 15.508 1.00 31.53 H new ATOM 0 HA GLU A 33 81.269 -18.607 14.526 1.00 74.11 H new ATOM 0 HB2 GLU A 33 82.016 -17.745 16.696 1.00 40.43 H new ATOM 0 HB3 GLU A 33 80.590 -16.887 16.147 1.00 40.43 H new ATOM 0 HG2 GLU A 33 79.170 -18.152 17.669 1.00 52.44 H new ATOM 0 HG3 GLU A 33 80.509 -19.185 18.128 1.00 52.44 H new ATOM 471 N GLN A 34 80.385 -21.107 16.385 1.00 62.41 N ATOM 472 CA GLN A 34 80.777 -22.426 16.867 1.00 50.02 C ATOM 473 C GLN A 34 79.554 -23.255 17.241 1.00 14.25 C ATOM 474 O GLN A 34 79.057 -23.174 18.365 1.00 11.43 O ATOM 475 CB GLN A 34 81.708 -22.295 18.073 1.00 34.33 C ATOM 476 CG GLN A 34 82.675 -23.458 18.226 1.00 12.51 C ATOM 477 CD GLN A 34 83.989 -23.046 18.861 1.00 53.43 C ATOM 478 OE1 GLN A 34 84.186 -23.204 20.066 1.00 40.15 O ATOM 479 NE2 GLN A 34 84.896 -22.514 18.049 1.00 31.33 N ATOM 0 H GLN A 34 79.387 -20.909 16.460 1.00 62.41 H new ATOM 0 HA GLN A 34 81.306 -22.937 16.062 1.00 50.02 H new ATOM 0 HB2 GLN A 34 82.277 -21.370 17.983 1.00 34.33 H new ATOM 0 HB3 GLN A 34 81.106 -22.212 18.978 1.00 34.33 H new ATOM 0 HG2 GLN A 34 82.210 -24.234 18.834 1.00 12.51 H new ATOM 0 HG3 GLN A 34 82.870 -23.894 17.246 1.00 12.51 H new ATOM 0 HE21 GLN A 34 84.689 -22.402 17.057 1.00 31.33 H new ATOM 0 HE22 GLN A 34 85.799 -22.217 18.418 1.00 31.33 H new ATOM 488 N SER A 35 79.072 -24.052 16.293 1.00 73.51 N ATOM 489 CA SER A 35 77.903 -24.893 16.523 1.00 54.44 C ATOM 490 C SER A 35 78.034 -26.220 15.780 1.00 44.50 C ATOM 491 O SER A 35 78.880 -26.369 14.899 1.00 55.02 O ATOM 492 CB SER A 35 76.632 -24.170 16.076 1.00 5.32 C ATOM 493 OG SER A 35 76.082 -23.404 17.135 1.00 44.54 O ATOM 0 H SER A 35 79.473 -24.133 15.359 1.00 73.51 H new ATOM 0 HA SER A 35 77.839 -25.099 17.592 1.00 54.44 H new ATOM 0 HB2 SER A 35 76.858 -23.519 15.231 1.00 5.32 H new ATOM 0 HB3 SER A 35 75.898 -24.898 15.730 1.00 5.32 H new ATOM 0 HG SER A 35 76.801 -23.105 17.730 1.00 44.54 H new ATOM 499 N GLY A 36 77.189 -27.180 16.142 1.00 4.21 N ATOM 500 CA GLY A 36 77.225 -28.481 15.500 1.00 71.33 C ATOM 501 C GLY A 36 76.181 -29.430 16.053 1.00 74.31 C ATOM 502 O GLY A 36 76.465 -30.222 16.951 1.00 60.30 O ATOM 0 H GLY A 36 76.480 -27.080 16.868 1.00 4.21 H new ATOM 0 HA2 GLY A 36 77.068 -28.358 14.428 1.00 71.33 H new ATOM 0 HA3 GLY A 36 78.215 -28.919 15.629 1.00 71.33 H new ATOM 506 N ALA A 37 74.968 -29.349 15.518 1.00 15.22 N ATOM 507 CA ALA A 37 73.877 -30.207 15.963 1.00 54.05 C ATOM 508 C ALA A 37 73.562 -31.278 14.924 1.00 0.42 C ATOM 509 O ALA A 37 74.266 -31.414 13.923 1.00 25.34 O ATOM 510 CB ALA A 37 72.638 -29.376 16.260 1.00 41.51 C ATOM 0 H ALA A 37 74.716 -28.697 14.775 1.00 15.22 H new ATOM 0 HA ALA A 37 74.192 -30.708 16.878 1.00 54.05 H new ATOM 0 HB1 ALA A 37 71.832 -30.030 16.591 1.00 41.51 H new ATOM 0 HB2 ALA A 37 72.864 -28.653 17.044 1.00 41.51 H new ATOM 0 HB3 ALA A 37 72.329 -28.848 15.358 1.00 41.51 H new ATOM 516 N VAL A 38 72.499 -32.038 15.169 1.00 74.04 N ATOM 517 CA VAL A 38 72.090 -33.098 14.254 1.00 53.43 C ATOM 518 C VAL A 38 70.948 -32.638 13.356 1.00 5.12 C ATOM 519 O VAL A 38 69.907 -32.190 13.839 1.00 51.25 O ATOM 520 CB VAL A 38 71.651 -34.361 15.018 1.00 1.33 C ATOM 521 CG1 VAL A 38 71.242 -35.457 14.046 1.00 34.22 C ATOM 522 CG2 VAL A 38 72.764 -34.840 15.938 1.00 33.00 C ATOM 0 H VAL A 38 71.906 -31.940 15.993 1.00 74.04 H new ATOM 0 HA VAL A 38 72.958 -33.338 13.639 1.00 53.43 H new ATOM 0 HB VAL A 38 70.786 -34.112 15.632 1.00 1.33 H new ATOM 0 HG11 VAL A 38 70.935 -36.342 14.604 1.00 34.22 H new ATOM 0 HG12 VAL A 38 70.411 -35.108 13.433 1.00 34.22 H new ATOM 0 HG13 VAL A 38 72.086 -35.708 13.404 1.00 34.22 H new ATOM 0 HG21 VAL A 38 72.437 -35.733 16.470 1.00 33.00 H new ATOM 0 HG22 VAL A 38 73.649 -35.074 15.347 1.00 33.00 H new ATOM 0 HG23 VAL A 38 73.004 -34.057 16.657 1.00 33.00 H new ATOM 532 N ILE A 39 71.148 -32.751 12.048 1.00 44.22 N ATOM 533 CA ILE A 39 70.134 -32.347 11.082 1.00 21.21 C ATOM 534 C ILE A 39 70.009 -33.369 9.957 1.00 63.14 C ATOM 535 O ILE A 39 70.982 -34.031 9.595 1.00 23.22 O ATOM 536 CB ILE A 39 70.451 -30.968 10.474 1.00 24.11 C ATOM 537 CG1 ILE A 39 69.278 -30.479 9.622 1.00 14.11 C ATOM 538 CG2 ILE A 39 71.724 -31.035 9.644 1.00 73.24 C ATOM 539 CD1 ILE A 39 69.491 -30.665 8.137 1.00 72.03 C ATOM 0 H ILE A 39 72.004 -33.119 11.632 1.00 44.22 H new ATOM 0 HA ILE A 39 69.190 -32.287 11.623 1.00 21.21 H new ATOM 0 HB ILE A 39 70.607 -30.257 11.286 1.00 24.11 H new ATOM 0 HG12 ILE A 39 68.375 -31.012 9.921 1.00 14.11 H new ATOM 0 HG13 ILE A 39 69.107 -29.422 9.827 1.00 14.11 H new ATOM 0 HG21 ILE A 39 71.935 -30.053 9.221 1.00 73.24 H new ATOM 0 HG22 ILE A 39 72.556 -31.343 10.278 1.00 73.24 H new ATOM 0 HG23 ILE A 39 71.595 -31.757 8.838 1.00 73.24 H new ATOM 0 HD11 ILE A 39 68.620 -30.296 7.595 1.00 72.03 H new ATOM 0 HD12 ILE A 39 70.375 -30.109 7.824 1.00 72.03 H new ATOM 0 HD13 ILE A 39 69.632 -31.724 7.919 1.00 72.03 H new ATOM 551 N ARG A 40 68.805 -33.491 9.406 1.00 25.11 N ATOM 552 CA ARG A 40 68.553 -34.431 8.321 1.00 10.01 C ATOM 553 C ARG A 40 68.358 -33.696 6.998 1.00 13.13 C ATOM 554 O ARG A 40 67.229 -33.458 6.570 1.00 10.13 O ATOM 555 CB ARG A 40 67.320 -35.282 8.632 1.00 0.32 C ATOM 556 CG ARG A 40 67.649 -36.624 9.263 1.00 34.31 C ATOM 557 CD ARG A 40 68.373 -36.452 10.590 1.00 12.33 C ATOM 558 NE ARG A 40 67.501 -35.898 11.621 1.00 22.43 N ATOM 559 CZ ARG A 40 66.604 -36.615 12.290 1.00 24.21 C ATOM 560 NH1 ARG A 40 66.462 -37.907 12.036 1.00 74.33 N ATOM 561 NH2 ARG A 40 65.848 -36.037 13.214 1.00 22.25 N ATOM 0 H ARG A 40 67.989 -32.950 9.694 1.00 25.11 H new ATOM 0 HA ARG A 40 69.422 -35.083 8.229 1.00 10.01 H new ATOM 0 HB2 ARG A 40 66.665 -34.726 9.303 1.00 0.32 H new ATOM 0 HB3 ARG A 40 66.763 -35.450 7.710 1.00 0.32 H new ATOM 0 HG2 ARG A 40 66.730 -37.189 9.419 1.00 34.31 H new ATOM 0 HG3 ARG A 40 68.269 -37.206 8.581 1.00 34.31 H new ATOM 0 HD2 ARG A 40 68.758 -37.417 10.921 1.00 12.33 H new ATOM 0 HD3 ARG A 40 69.233 -35.796 10.452 1.00 12.33 H new ATOM 0 HE ARG A 40 67.585 -34.905 11.840 1.00 22.43 H new ATOM 0 HH11 ARG A 40 67.042 -38.354 11.326 1.00 74.33 H new ATOM 0 HH12 ARG A 40 65.773 -38.455 12.551 1.00 74.33 H new ATOM 0 HH21 ARG A 40 65.955 -35.042 13.411 1.00 22.25 H new ATOM 0 HH22 ARG A 40 65.160 -36.588 13.727 1.00 22.25 H new ATOM 575 N GLY A 41 69.466 -33.338 6.357 1.00 2.34 N ATOM 576 CA GLY A 41 69.394 -32.633 5.091 1.00 41.45 C ATOM 577 C GLY A 41 70.462 -33.084 4.115 1.00 43.24 C ATOM 578 O GLY A 41 71.592 -33.372 4.509 1.00 4.40 O ATOM 0 H GLY A 41 70.412 -33.523 6.692 1.00 2.34 H new ATOM 0 HA2 GLY A 41 68.411 -32.789 4.647 1.00 41.45 H new ATOM 0 HA3 GLY A 41 69.497 -31.562 5.268 1.00 41.45 H new ATOM 582 N VAL A 42 70.103 -33.149 2.836 1.00 65.41 N ATOM 583 CA VAL A 42 71.039 -33.570 1.800 1.00 62.52 C ATOM 584 C VAL A 42 71.078 -32.566 0.653 1.00 74.43 C ATOM 585 O VAL A 42 70.049 -32.015 0.262 1.00 44.22 O ATOM 586 CB VAL A 42 70.672 -34.957 1.241 1.00 62.42 C ATOM 587 CG1 VAL A 42 69.405 -34.877 0.404 1.00 21.10 C ATOM 588 CG2 VAL A 42 71.824 -35.525 0.426 1.00 71.12 C ATOM 0 H VAL A 42 69.171 -32.916 2.493 1.00 65.41 H new ATOM 0 HA VAL A 42 72.023 -33.623 2.266 1.00 62.52 H new ATOM 0 HB VAL A 42 70.484 -35.629 2.079 1.00 62.42 H new ATOM 0 HG11 VAL A 42 69.161 -35.867 0.017 1.00 21.10 H new ATOM 0 HG12 VAL A 42 68.583 -34.516 1.022 1.00 21.10 H new ATOM 0 HG13 VAL A 42 69.561 -34.191 -0.428 1.00 21.10 H new ATOM 0 HG21 VAL A 42 71.547 -36.506 0.039 1.00 71.12 H new ATOM 0 HG22 VAL A 42 72.046 -34.856 -0.405 1.00 71.12 H new ATOM 0 HG23 VAL A 42 72.706 -35.621 1.060 1.00 71.12 H new ATOM 598 N PHE A 43 72.271 -32.333 0.117 1.00 73.24 N ATOM 599 CA PHE A 43 72.445 -31.396 -0.986 1.00 5.44 C ATOM 600 C PHE A 43 72.305 -32.104 -2.330 1.00 64.10 C ATOM 601 O PHE A 43 72.848 -33.192 -2.530 1.00 21.45 O ATOM 602 CB PHE A 43 73.812 -30.715 -0.894 1.00 44.54 C ATOM 603 CG PHE A 43 74.911 -31.482 -1.573 1.00 54.23 C ATOM 604 CD1 PHE A 43 75.294 -32.729 -1.104 1.00 71.42 C ATOM 605 CD2 PHE A 43 75.558 -30.959 -2.680 1.00 25.51 C ATOM 606 CE1 PHE A 43 76.305 -33.437 -1.726 1.00 72.40 C ATOM 607 CE2 PHE A 43 76.570 -31.663 -3.306 1.00 42.30 C ATOM 608 CZ PHE A 43 76.943 -32.904 -2.829 1.00 3.32 C ATOM 0 H PHE A 43 73.133 -32.781 0.429 1.00 73.24 H new ATOM 0 HA PHE A 43 71.664 -30.639 -0.913 1.00 5.44 H new ATOM 0 HB2 PHE A 43 73.745 -29.722 -1.338 1.00 44.54 H new ATOM 0 HB3 PHE A 43 74.071 -30.578 0.156 1.00 44.54 H new ATOM 0 HD1 PHE A 43 74.797 -33.152 -0.243 1.00 71.42 H new ATOM 0 HD2 PHE A 43 75.269 -29.990 -3.059 1.00 25.51 H new ATOM 0 HE1 PHE A 43 76.596 -34.407 -1.350 1.00 72.40 H new ATOM 0 HE2 PHE A 43 77.068 -31.243 -4.167 1.00 42.30 H new ATOM 0 HZ PHE A 43 77.732 -33.457 -3.317 1.00 3.32 H new ATOM 618 N ASP A 44 71.576 -31.481 -3.248 1.00 10.22 N ATOM 619 CA ASP A 44 71.364 -32.050 -4.574 1.00 71.14 C ATOM 620 C ASP A 44 71.760 -31.056 -5.661 1.00 62.22 C ATOM 621 O ASP A 44 71.276 -29.925 -5.688 1.00 13.41 O ATOM 622 CB ASP A 44 69.902 -32.461 -4.749 1.00 12.00 C ATOM 623 CG ASP A 44 69.557 -32.777 -6.191 1.00 64.14 C ATOM 624 OD1 ASP A 44 70.036 -33.811 -6.703 1.00 22.34 O ATOM 625 OD2 ASP A 44 68.811 -31.989 -6.809 1.00 11.21 O ATOM 0 H ASP A 44 71.121 -30.580 -3.099 1.00 10.22 H new ATOM 0 HA ASP A 44 71.995 -32.934 -4.668 1.00 71.14 H new ATOM 0 HB2 ASP A 44 69.697 -33.334 -4.130 1.00 12.00 H new ATOM 0 HB3 ASP A 44 69.257 -31.658 -4.392 1.00 12.00 H new ATOM 630 N ASP A 45 72.644 -31.486 -6.555 1.00 10.33 N ATOM 631 CA ASP A 45 73.105 -30.634 -7.646 1.00 13.55 C ATOM 632 C ASP A 45 72.396 -30.989 -8.949 1.00 13.34 C ATOM 633 O ASP A 45 71.952 -32.118 -9.155 1.00 60.15 O ATOM 634 CB ASP A 45 74.618 -30.767 -7.821 1.00 75.32 C ATOM 635 CG ASP A 45 75.392 -30.057 -6.727 1.00 53.45 C ATOM 636 OD1 ASP A 45 75.221 -30.422 -5.545 1.00 51.14 O ATOM 637 OD2 ASP A 45 76.170 -29.137 -7.054 1.00 53.10 O ATOM 0 H ASP A 45 73.056 -32.419 -6.546 1.00 10.33 H new ATOM 0 HA ASP A 45 72.866 -29.601 -7.393 1.00 13.55 H new ATOM 0 HB2 ASP A 45 74.889 -31.823 -7.827 1.00 75.32 H new ATOM 0 HB3 ASP A 45 74.906 -30.359 -8.790 1.00 75.32 H new ATOM 642 N PRO A 46 72.285 -30.002 -9.850 1.00 63.32 N ATOM 643 CA PRO A 46 71.631 -30.185 -11.149 1.00 51.52 C ATOM 644 C PRO A 46 72.438 -31.080 -12.083 1.00 51.42 C ATOM 645 O PRO A 46 71.899 -32.006 -12.688 1.00 14.41 O ATOM 646 CB PRO A 46 71.548 -28.763 -11.709 1.00 51.03 C ATOM 647 CG PRO A 46 72.661 -28.029 -11.043 1.00 11.43 C ATOM 648 CD PRO A 46 72.790 -28.630 -9.670 1.00 42.55 C ATOM 0 HA PRO A 46 70.663 -30.676 -11.052 1.00 51.52 H new ATOM 0 HB2 PRO A 46 71.662 -28.757 -12.793 1.00 51.03 H new ATOM 0 HB3 PRO A 46 70.584 -28.306 -11.488 1.00 51.03 H new ATOM 0 HG2 PRO A 46 73.589 -28.135 -11.604 1.00 11.43 H new ATOM 0 HG3 PRO A 46 72.445 -26.962 -10.983 1.00 11.43 H new ATOM 0 HD2 PRO A 46 73.824 -28.624 -9.324 1.00 42.55 H new ATOM 0 HD3 PRO A 46 72.205 -28.080 -8.934 1.00 42.55 H new ATOM 656 N GLU A 47 73.731 -30.797 -12.196 1.00 21.53 N ATOM 657 CA GLU A 47 74.611 -31.577 -13.058 1.00 71.11 C ATOM 658 C GLU A 47 76.045 -31.060 -12.982 1.00 5.33 C ATOM 659 O GLU A 47 76.366 -30.007 -13.531 1.00 1.24 O ATOM 660 CB GLU A 47 74.117 -31.531 -14.505 1.00 12.12 C ATOM 661 CG GLU A 47 75.112 -32.091 -15.507 1.00 74.33 C ATOM 662 CD GLU A 47 74.530 -32.213 -16.901 1.00 54.44 C ATOM 663 OE1 GLU A 47 73.501 -32.904 -17.057 1.00 2.32 O ATOM 664 OE2 GLU A 47 75.105 -31.619 -17.838 1.00 34.21 O ATOM 0 H GLU A 47 74.193 -30.034 -11.702 1.00 21.53 H new ATOM 0 HA GLU A 47 74.596 -32.610 -12.710 1.00 71.11 H new ATOM 0 HB2 GLU A 47 73.185 -32.091 -14.580 1.00 12.12 H new ATOM 0 HB3 GLU A 47 73.890 -30.498 -14.770 1.00 12.12 H new ATOM 0 HG2 GLU A 47 75.991 -31.447 -15.539 1.00 74.33 H new ATOM 0 HG3 GLU A 47 75.448 -33.072 -15.170 1.00 74.33 H new ATOM 671 N ASN A 48 76.904 -31.809 -12.298 1.00 10.24 N ATOM 672 CA ASN A 48 78.303 -31.426 -12.149 1.00 53.31 C ATOM 673 C ASN A 48 78.931 -31.121 -13.506 1.00 0.04 C ATOM 674 O ASN A 48 79.223 -32.029 -14.283 1.00 73.14 O ATOM 675 CB ASN A 48 79.086 -32.540 -11.450 1.00 44.45 C ATOM 676 CG ASN A 48 80.578 -32.267 -11.423 1.00 13.22 C ATOM 677 OD1 ASN A 48 81.064 -31.500 -10.593 1.00 21.32 O ATOM 678 ND2 ASN A 48 81.310 -32.897 -12.334 1.00 21.30 N ATOM 0 H ASN A 48 76.655 -32.685 -11.838 1.00 10.24 H new ATOM 0 HA ASN A 48 78.345 -30.524 -11.539 1.00 53.31 H new ATOM 0 HB2 ASN A 48 78.721 -32.652 -10.429 1.00 44.45 H new ATOM 0 HB3 ASN A 48 78.901 -33.486 -11.960 1.00 44.45 H new ATOM 0 HD21 ASN A 48 82.319 -32.754 -12.365 1.00 21.30 H new ATOM 0 HD22 ASN A 48 80.863 -33.524 -13.003 1.00 21.30 H new ATOM 685 N ILE A 49 79.134 -29.837 -13.782 1.00 51.15 N ATOM 686 CA ILE A 49 79.728 -29.414 -15.043 1.00 63.42 C ATOM 687 C ILE A 49 81.216 -29.744 -15.088 1.00 41.34 C ATOM 688 O ILE A 49 81.914 -29.654 -14.079 1.00 21.44 O ATOM 689 CB ILE A 49 79.543 -27.902 -15.273 1.00 42.23 C ATOM 690 CG1 ILE A 49 80.033 -27.512 -16.669 1.00 50.33 C ATOM 691 CG2 ILE A 49 80.282 -27.109 -14.205 1.00 12.31 C ATOM 692 CD1 ILE A 49 79.258 -28.172 -17.788 1.00 61.34 C ATOM 0 H ILE A 49 78.896 -29.073 -13.150 1.00 51.15 H new ATOM 0 HA ILE A 49 79.213 -29.960 -15.833 1.00 63.42 H new ATOM 0 HB ILE A 49 78.481 -27.666 -15.203 1.00 42.23 H new ATOM 0 HG12 ILE A 49 79.965 -26.430 -16.780 1.00 50.33 H new ATOM 0 HG13 ILE A 49 81.086 -27.776 -16.762 1.00 50.33 H new ATOM 0 HG21 ILE A 49 80.142 -26.043 -14.381 1.00 12.31 H new ATOM 0 HG22 ILE A 49 79.890 -27.369 -13.222 1.00 12.31 H new ATOM 0 HG23 ILE A 49 81.345 -27.347 -14.246 1.00 12.31 H new ATOM 0 HD11 ILE A 49 79.660 -27.850 -18.748 1.00 61.34 H new ATOM 0 HD12 ILE A 49 79.347 -29.255 -17.703 1.00 61.34 H new ATOM 0 HD13 ILE A 49 78.208 -27.888 -17.720 1.00 61.34 H new ATOM 704 N SER A 50 81.696 -30.126 -16.267 1.00 43.53 N ATOM 705 CA SER A 50 83.102 -30.472 -16.446 1.00 11.02 C ATOM 706 C SER A 50 83.831 -29.393 -17.238 1.00 64.10 C ATOM 707 O SER A 50 83.287 -28.317 -17.491 1.00 75.44 O ATOM 708 CB SER A 50 83.231 -31.819 -17.159 1.00 54.22 C ATOM 709 OG SER A 50 84.480 -32.427 -16.880 1.00 22.33 O ATOM 0 H SER A 50 81.132 -30.204 -17.113 1.00 43.53 H new ATOM 0 HA SER A 50 83.560 -30.546 -15.460 1.00 11.02 H new ATOM 0 HB2 SER A 50 82.423 -32.479 -16.844 1.00 54.22 H new ATOM 0 HB3 SER A 50 83.125 -31.676 -18.234 1.00 54.22 H new ATOM 0 HG SER A 50 84.536 -33.287 -17.346 1.00 22.33 H new ATOM 715 N TYR A 51 85.066 -29.687 -17.629 1.00 24.21 N ATOM 716 CA TYR A 51 85.873 -28.741 -18.391 1.00 11.40 C ATOM 717 C TYR A 51 85.116 -28.245 -19.619 1.00 5.21 C ATOM 718 O TYR A 51 84.180 -28.892 -20.089 1.00 74.25 O ATOM 719 CB TYR A 51 87.190 -29.391 -18.819 1.00 2.52 C ATOM 720 CG TYR A 51 88.208 -28.405 -19.346 1.00 71.03 C ATOM 721 CD1 TYR A 51 89.031 -27.696 -18.479 1.00 1.32 C ATOM 722 CD2 TYR A 51 88.348 -28.183 -20.710 1.00 3.31 C ATOM 723 CE1 TYR A 51 89.962 -26.793 -18.956 1.00 73.24 C ATOM 724 CE2 TYR A 51 89.278 -27.283 -21.196 1.00 14.35 C ATOM 725 CZ TYR A 51 90.082 -26.592 -20.315 1.00 2.02 C ATOM 726 OH TYR A 51 91.008 -25.694 -20.794 1.00 41.12 O ATOM 0 H TYR A 51 85.530 -30.573 -17.431 1.00 24.21 H new ATOM 0 HA TYR A 51 86.088 -27.887 -17.749 1.00 11.40 H new ATOM 0 HB2 TYR A 51 87.617 -29.922 -17.968 1.00 2.52 H new ATOM 0 HB3 TYR A 51 86.985 -30.135 -19.589 1.00 2.52 H new ATOM 0 HD1 TYR A 51 88.941 -27.853 -17.414 1.00 1.32 H new ATOM 0 HD2 TYR A 51 87.719 -28.723 -21.403 1.00 3.31 H new ATOM 0 HE1 TYR A 51 90.592 -26.248 -18.269 1.00 73.24 H new ATOM 0 HE2 TYR A 51 89.374 -27.122 -22.260 1.00 14.35 H new ATOM 0 HH TYR A 51 90.966 -25.671 -21.773 1.00 41.12 H new ATOM 736 N ALA A 52 85.527 -27.091 -20.134 1.00 34.43 N ATOM 737 CA ALA A 52 84.891 -26.507 -21.308 1.00 55.32 C ATOM 738 C ALA A 52 85.907 -26.264 -22.419 1.00 14.12 C ATOM 739 O ALA A 52 85.942 -26.992 -23.411 1.00 20.23 O ATOM 740 CB ALA A 52 84.190 -25.209 -20.938 1.00 14.24 C ATOM 0 H ALA A 52 86.299 -26.542 -19.756 1.00 34.43 H new ATOM 0 HA ALA A 52 84.149 -27.215 -21.678 1.00 55.32 H new ATOM 0 HB1 ALA A 52 83.719 -24.784 -21.825 1.00 14.24 H new ATOM 0 HB2 ALA A 52 83.429 -25.409 -20.184 1.00 14.24 H new ATOM 0 HB3 ALA A 52 84.919 -24.503 -20.540 1.00 14.24 H new ATOM 746 N GLY A 53 86.730 -25.236 -22.246 1.00 62.44 N ATOM 747 CA GLY A 53 87.736 -24.915 -23.243 1.00 5.40 C ATOM 748 C GLY A 53 87.450 -23.607 -23.953 1.00 44.00 C ATOM 749 O GLY A 53 87.662 -23.489 -25.160 1.00 52.34 O ATOM 0 H GLY A 53 86.719 -24.619 -21.434 1.00 62.44 H new ATOM 0 HA2 GLY A 53 88.713 -24.859 -22.764 1.00 5.40 H new ATOM 0 HA3 GLY A 53 87.786 -25.720 -23.976 1.00 5.40 H new ATOM 753 N GLN A 54 86.966 -22.621 -23.205 1.00 35.13 N ATOM 754 CA GLN A 54 86.649 -21.316 -23.771 1.00 41.21 C ATOM 755 C GLN A 54 87.355 -20.203 -23.004 1.00 32.24 C ATOM 756 O GLN A 54 87.812 -19.223 -23.590 1.00 45.45 O ATOM 757 CB GLN A 54 85.137 -21.083 -23.755 1.00 61.41 C ATOM 758 CG GLN A 54 84.449 -21.466 -25.055 1.00 60.00 C ATOM 759 CD GLN A 54 82.984 -21.077 -25.075 1.00 52.55 C ATOM 760 OE1 GLN A 54 82.480 -20.458 -24.138 1.00 44.12 O ATOM 761 NE2 GLN A 54 82.289 -21.442 -26.149 1.00 24.52 N ATOM 0 H GLN A 54 86.785 -22.702 -22.204 1.00 35.13 H new ATOM 0 HA GLN A 54 87.001 -21.301 -24.802 1.00 41.21 H new ATOM 0 HB2 GLN A 54 84.698 -21.656 -22.939 1.00 61.41 H new ATOM 0 HB3 GLN A 54 84.942 -20.031 -23.547 1.00 61.41 H new ATOM 0 HG2 GLN A 54 84.961 -20.984 -25.888 1.00 60.00 H new ATOM 0 HG3 GLN A 54 84.538 -22.542 -25.206 1.00 60.00 H new ATOM 0 HE21 GLN A 54 82.747 -21.954 -26.903 1.00 24.52 H new ATOM 0 HE22 GLN A 54 81.298 -21.210 -26.219 1.00 24.52 H new ATOM 770 N GLY A 55 87.439 -20.361 -21.686 1.00 25.44 N ATOM 771 CA GLY A 55 88.090 -19.360 -20.860 1.00 74.44 C ATOM 772 C GLY A 55 87.159 -18.773 -19.818 1.00 5.50 C ATOM 773 O GLY A 55 87.413 -17.692 -19.286 1.00 4.12 O ATOM 0 H GLY A 55 87.068 -21.163 -21.176 1.00 25.44 H new ATOM 0 HA2 GLY A 55 88.951 -19.808 -20.363 1.00 74.44 H new ATOM 0 HA3 GLY A 55 88.469 -18.560 -21.496 1.00 74.44 H new ATOM 777 N VAL A 56 86.074 -19.483 -19.528 1.00 12.40 N ATOM 778 CA VAL A 56 85.099 -19.025 -18.545 1.00 20.50 C ATOM 779 C VAL A 56 84.646 -20.170 -17.647 1.00 31.31 C ATOM 780 O VAL A 56 83.699 -20.888 -17.969 1.00 53.14 O ATOM 781 CB VAL A 56 83.867 -18.401 -19.225 1.00 32.32 C ATOM 782 CG1 VAL A 56 82.950 -17.767 -18.190 1.00 20.20 C ATOM 783 CG2 VAL A 56 84.294 -17.379 -20.267 1.00 70.25 C ATOM 0 H VAL A 56 85.848 -20.379 -19.960 1.00 12.40 H new ATOM 0 HA VAL A 56 85.593 -18.265 -17.939 1.00 20.50 H new ATOM 0 HB VAL A 56 83.313 -19.192 -19.731 1.00 32.32 H new ATOM 0 HG11 VAL A 56 82.085 -17.331 -18.689 1.00 20.20 H new ATOM 0 HG12 VAL A 56 82.617 -18.528 -17.484 1.00 20.20 H new ATOM 0 HG13 VAL A 56 83.491 -16.987 -17.654 1.00 20.20 H new ATOM 0 HG21 VAL A 56 83.410 -16.948 -20.738 1.00 70.25 H new ATOM 0 HG22 VAL A 56 84.871 -16.589 -19.787 1.00 70.25 H new ATOM 0 HG23 VAL A 56 84.907 -17.867 -21.025 1.00 70.25 H new ATOM 793 N ARG A 57 85.326 -20.334 -16.517 1.00 35.41 N ATOM 794 CA ARG A 57 84.994 -21.393 -15.571 1.00 1.42 C ATOM 795 C ARG A 57 83.543 -21.273 -15.110 1.00 72.04 C ATOM 796 O ARG A 57 82.870 -20.283 -15.395 1.00 74.02 O ATOM 797 CB ARG A 57 85.930 -21.338 -14.362 1.00 54.11 C ATOM 798 CG ARG A 57 87.355 -21.765 -14.676 1.00 43.42 C ATOM 799 CD ARG A 57 88.186 -20.597 -15.183 1.00 74.03 C ATOM 800 NE ARG A 57 89.619 -20.860 -15.081 1.00 51.11 N ATOM 801 CZ ARG A 57 90.552 -20.055 -15.577 1.00 53.44 C ATOM 802 NH1 ARG A 57 90.203 -18.941 -16.207 1.00 73.25 N ATOM 803 NH2 ARG A 57 91.835 -20.363 -15.444 1.00 64.44 N ATOM 0 H ARG A 57 86.111 -19.747 -16.234 1.00 35.41 H new ATOM 0 HA ARG A 57 85.120 -22.351 -16.076 1.00 1.42 H new ATOM 0 HB2 ARG A 57 85.942 -20.322 -13.969 1.00 54.11 H new ATOM 0 HB3 ARG A 57 85.532 -21.979 -13.576 1.00 54.11 H new ATOM 0 HG2 ARG A 57 87.817 -22.181 -13.781 1.00 43.42 H new ATOM 0 HG3 ARG A 57 87.342 -22.557 -15.425 1.00 43.42 H new ATOM 0 HD2 ARG A 57 87.928 -20.393 -16.222 1.00 74.03 H new ATOM 0 HD3 ARG A 57 87.940 -19.702 -14.611 1.00 74.03 H new ATOM 0 HE ARG A 57 89.920 -21.709 -14.602 1.00 51.11 H new ATOM 0 HH11 ARG A 57 89.217 -18.701 -16.311 1.00 73.25 H new ATOM 0 HH12 ARG A 57 90.921 -18.324 -16.587 1.00 73.25 H new ATOM 0 HH21 ARG A 57 92.107 -21.219 -14.960 1.00 64.44 H new ATOM 0 HH22 ARG A 57 92.550 -19.744 -15.825 1.00 64.44 H new ATOM 817 N VAL A 58 83.069 -22.290 -14.398 1.00 54.11 N ATOM 818 CA VAL A 58 81.700 -22.300 -13.897 1.00 71.02 C ATOM 819 C VAL A 58 81.383 -21.016 -13.139 1.00 43.24 C ATOM 820 O VAL A 58 82.253 -20.434 -12.494 1.00 70.31 O ATOM 821 CB VAL A 58 81.450 -23.506 -12.971 1.00 4.23 C ATOM 822 CG1 VAL A 58 82.265 -23.376 -11.693 1.00 5.15 C ATOM 823 CG2 VAL A 58 79.967 -23.637 -12.656 1.00 23.13 C ATOM 0 H VAL A 58 83.613 -23.118 -14.155 1.00 54.11 H new ATOM 0 HA VAL A 58 81.045 -22.377 -14.765 1.00 71.02 H new ATOM 0 HB VAL A 58 81.770 -24.411 -13.487 1.00 4.23 H new ATOM 0 HG11 VAL A 58 82.076 -24.237 -11.052 1.00 5.15 H new ATOM 0 HG12 VAL A 58 83.326 -23.334 -11.941 1.00 5.15 H new ATOM 0 HG13 VAL A 58 81.979 -22.464 -11.170 1.00 5.15 H new ATOM 0 HG21 VAL A 58 79.808 -24.494 -12.001 1.00 23.13 H new ATOM 0 HG22 VAL A 58 79.619 -22.731 -12.159 1.00 23.13 H new ATOM 0 HG23 VAL A 58 79.410 -23.780 -13.582 1.00 23.13 H new ATOM 833 N GLU A 59 80.129 -20.580 -13.222 1.00 53.23 N ATOM 834 CA GLU A 59 79.697 -19.364 -12.543 1.00 50.12 C ATOM 835 C GLU A 59 79.421 -19.634 -11.067 1.00 61.10 C ATOM 836 O GLU A 59 80.210 -19.265 -10.199 1.00 3.21 O ATOM 837 CB GLU A 59 78.445 -18.798 -13.214 1.00 11.52 C ATOM 838 CG GLU A 59 78.740 -17.741 -14.264 1.00 60.25 C ATOM 839 CD GLU A 59 79.398 -18.318 -15.503 1.00 11.45 C ATOM 840 OE1 GLU A 59 80.635 -18.488 -15.495 1.00 1.15 O ATOM 841 OE2 GLU A 59 78.673 -18.599 -16.481 1.00 65.10 O ATOM 0 H GLU A 59 79.396 -21.051 -13.752 1.00 53.23 H new ATOM 0 HA GLU A 59 80.501 -18.632 -12.615 1.00 50.12 H new ATOM 0 HB2 GLU A 59 77.892 -19.614 -13.678 1.00 11.52 H new ATOM 0 HB3 GLU A 59 77.797 -18.368 -12.450 1.00 11.52 H new ATOM 0 HG2 GLU A 59 77.811 -17.246 -14.547 1.00 60.25 H new ATOM 0 HG3 GLU A 59 79.389 -16.978 -13.834 1.00 60.25 H new ATOM 848 N GLY A 60 78.292 -20.281 -10.792 1.00 33.23 N ATOM 849 CA GLY A 60 77.930 -20.589 -9.420 1.00 5.23 C ATOM 850 C GLY A 60 77.104 -21.854 -9.309 1.00 2.34 C ATOM 851 O GLY A 60 76.347 -22.192 -10.219 1.00 2.00 O ATOM 0 H GLY A 60 77.622 -20.597 -11.494 1.00 33.23 H new ATOM 0 HA2 GLY A 60 78.836 -20.697 -8.824 1.00 5.23 H new ATOM 0 HA3 GLY A 60 77.369 -19.754 -8.999 1.00 5.23 H new ATOM 855 N SER A 61 77.247 -22.557 -8.190 1.00 23.41 N ATOM 856 CA SER A 61 76.512 -23.796 -7.965 1.00 12.02 C ATOM 857 C SER A 61 75.716 -23.727 -6.665 1.00 74.52 C ATOM 858 O SER A 61 76.269 -23.453 -5.600 1.00 61.54 O ATOM 859 CB SER A 61 77.473 -24.984 -7.926 1.00 74.33 C ATOM 860 OG SER A 61 78.629 -24.732 -8.708 1.00 53.31 O ATOM 0 H SER A 61 77.866 -22.289 -7.425 1.00 23.41 H new ATOM 0 HA SER A 61 75.814 -23.931 -8.791 1.00 12.02 H new ATOM 0 HB2 SER A 61 77.764 -25.186 -6.895 1.00 74.33 H new ATOM 0 HB3 SER A 61 76.968 -25.877 -8.295 1.00 74.33 H new ATOM 0 HG SER A 61 79.228 -25.506 -8.665 1.00 53.31 H new ATOM 866 N SER A 62 74.415 -23.978 -6.761 1.00 73.23 N ATOM 867 CA SER A 62 73.542 -23.942 -5.593 1.00 1.02 C ATOM 868 C SER A 62 72.706 -25.215 -5.499 1.00 61.45 C ATOM 869 O SER A 62 71.671 -25.358 -6.150 1.00 32.45 O ATOM 870 CB SER A 62 72.624 -22.719 -5.655 1.00 43.22 C ATOM 871 OG SER A 62 71.776 -22.775 -6.789 1.00 40.52 O ATOM 0 H SER A 62 73.942 -24.208 -7.635 1.00 73.23 H new ATOM 0 HA SER A 62 74.168 -23.874 -4.704 1.00 1.02 H new ATOM 0 HB2 SER A 62 72.021 -22.667 -4.748 1.00 43.22 H new ATOM 0 HB3 SER A 62 73.225 -21.811 -5.691 1.00 43.22 H new ATOM 0 HG SER A 62 71.472 -23.697 -6.925 1.00 40.52 H new ATOM 877 N PRO A 63 73.167 -26.163 -4.670 1.00 15.41 N ATOM 878 CA PRO A 63 72.478 -27.442 -4.470 1.00 42.04 C ATOM 879 C PRO A 63 71.164 -27.280 -3.714 1.00 53.12 C ATOM 880 O PRO A 63 70.901 -26.233 -3.124 1.00 71.05 O ATOM 881 CB PRO A 63 73.476 -28.257 -3.642 1.00 2.43 C ATOM 882 CG PRO A 63 74.300 -27.238 -2.933 1.00 11.35 C ATOM 883 CD PRO A 63 74.395 -26.061 -3.865 1.00 20.54 C ATOM 0 HA PRO A 63 72.205 -27.911 -5.416 1.00 42.04 H new ATOM 0 HB2 PRO A 63 72.964 -28.912 -2.937 1.00 2.43 H new ATOM 0 HB3 PRO A 63 74.093 -28.892 -4.278 1.00 2.43 H new ATOM 0 HG2 PRO A 63 73.838 -26.951 -1.988 1.00 11.35 H new ATOM 0 HG3 PRO A 63 75.289 -27.631 -2.698 1.00 11.35 H new ATOM 0 HD2 PRO A 63 74.440 -25.119 -3.319 1.00 20.54 H new ATOM 0 HD3 PRO A 63 75.289 -26.112 -4.487 1.00 20.54 H new ATOM 891 N SER A 64 70.342 -28.325 -3.735 1.00 62.01 N ATOM 892 CA SER A 64 69.053 -28.297 -3.054 1.00 13.21 C ATOM 893 C SER A 64 69.085 -29.159 -1.796 1.00 75.22 C ATOM 894 O SER A 64 69.712 -30.220 -1.771 1.00 40.22 O ATOM 895 CB SER A 64 67.947 -28.785 -3.991 1.00 5.41 C ATOM 896 OG SER A 64 66.817 -29.228 -3.260 1.00 25.14 O ATOM 0 H SER A 64 70.546 -29.201 -4.216 1.00 62.01 H new ATOM 0 HA SER A 64 68.846 -27.267 -2.763 1.00 13.21 H new ATOM 0 HB2 SER A 64 67.655 -27.979 -4.665 1.00 5.41 H new ATOM 0 HB3 SER A 64 68.324 -29.598 -4.611 1.00 5.41 H new ATOM 0 HG SER A 64 66.124 -29.533 -3.882 1.00 25.14 H new ATOM 902 N LEU A 65 68.406 -28.697 -0.752 1.00 3.33 N ATOM 903 CA LEU A 65 68.356 -29.425 0.511 1.00 51.41 C ATOM 904 C LEU A 65 66.937 -29.899 0.811 1.00 2.42 C ATOM 905 O LEU A 65 66.015 -29.092 0.934 1.00 44.20 O ATOM 906 CB LEU A 65 68.861 -28.540 1.652 1.00 33.30 C ATOM 907 CG LEU A 65 68.103 -28.653 2.975 1.00 33.34 C ATOM 908 CD1 LEU A 65 69.064 -28.562 4.150 1.00 25.32 C ATOM 909 CD2 LEU A 65 67.035 -27.573 3.072 1.00 60.25 C ATOM 0 H LEU A 65 67.882 -27.822 -0.755 1.00 3.33 H new ATOM 0 HA LEU A 65 69.001 -30.299 0.424 1.00 51.41 H new ATOM 0 HB2 LEU A 65 69.908 -28.780 1.835 1.00 33.30 H new ATOM 0 HB3 LEU A 65 68.825 -27.501 1.323 1.00 33.30 H new ATOM 0 HG LEU A 65 67.612 -29.625 3.008 1.00 33.34 H new ATOM 0 HD11 LEU A 65 68.507 -28.644 5.083 1.00 25.32 H new ATOM 0 HD12 LEU A 65 69.791 -29.372 4.089 1.00 25.32 H new ATOM 0 HD13 LEU A 65 69.584 -27.605 4.121 1.00 25.32 H new ATOM 0 HD21 LEU A 65 66.506 -27.669 4.020 1.00 60.25 H new ATOM 0 HD22 LEU A 65 67.505 -26.591 3.016 1.00 60.25 H new ATOM 0 HD23 LEU A 65 66.329 -27.685 2.249 1.00 60.25 H new ATOM 921 N PHE A 66 66.769 -31.211 0.928 1.00 14.12 N ATOM 922 CA PHE A 66 65.463 -31.793 1.214 1.00 24.42 C ATOM 923 C PHE A 66 65.354 -32.187 2.685 1.00 53.04 C ATOM 924 O PHE A 66 65.997 -33.136 3.134 1.00 53.20 O ATOM 925 CB PHE A 66 65.219 -33.015 0.327 1.00 41.00 C ATOM 926 CG PHE A 66 63.983 -33.786 0.693 1.00 32.41 C ATOM 927 CD1 PHE A 66 62.757 -33.459 0.138 1.00 22.20 C ATOM 928 CD2 PHE A 66 64.048 -34.837 1.594 1.00 54.24 C ATOM 929 CE1 PHE A 66 61.618 -34.165 0.474 1.00 15.02 C ATOM 930 CE2 PHE A 66 62.913 -35.548 1.933 1.00 15.32 C ATOM 931 CZ PHE A 66 61.696 -35.213 1.372 1.00 31.12 C ATOM 0 H PHE A 66 67.521 -31.892 0.829 1.00 14.12 H new ATOM 0 HA PHE A 66 64.703 -31.041 1.000 1.00 24.42 H new ATOM 0 HB2 PHE A 66 65.141 -32.691 -0.711 1.00 41.00 H new ATOM 0 HB3 PHE A 66 66.082 -33.677 0.390 1.00 41.00 H new ATOM 0 HD1 PHE A 66 62.691 -32.642 -0.566 1.00 22.20 H new ATOM 0 HD2 PHE A 66 64.997 -35.103 2.036 1.00 54.24 H new ATOM 0 HE1 PHE A 66 60.668 -33.898 0.036 1.00 15.02 H new ATOM 0 HE2 PHE A 66 62.977 -36.365 2.636 1.00 15.32 H new ATOM 0 HZ PHE A 66 60.808 -35.768 1.634 1.00 31.12 H new ATOM 941 N VAL A 67 64.535 -31.452 3.429 1.00 22.14 N ATOM 942 CA VAL A 67 64.339 -31.725 4.849 1.00 64.43 C ATOM 943 C VAL A 67 62.870 -31.603 5.235 1.00 3.30 C ATOM 944 O VAL A 67 62.051 -31.119 4.454 1.00 12.20 O ATOM 945 CB VAL A 67 65.170 -30.766 5.723 1.00 23.00 C ATOM 946 CG1 VAL A 67 66.646 -30.862 5.369 1.00 54.14 C ATOM 947 CG2 VAL A 67 64.670 -29.337 5.571 1.00 55.33 C ATOM 0 H VAL A 67 63.996 -30.663 3.073 1.00 22.14 H new ATOM 0 HA VAL A 67 64.673 -32.748 5.024 1.00 64.43 H new ATOM 0 HB VAL A 67 65.051 -31.060 6.766 1.00 23.00 H new ATOM 0 HG11 VAL A 67 67.216 -30.177 5.997 1.00 54.14 H new ATOM 0 HG12 VAL A 67 66.994 -31.881 5.535 1.00 54.14 H new ATOM 0 HG13 VAL A 67 66.787 -30.596 4.321 1.00 54.14 H new ATOM 0 HG21 VAL A 67 65.269 -28.674 6.195 1.00 55.33 H new ATOM 0 HG22 VAL A 67 64.757 -29.030 4.529 1.00 55.33 H new ATOM 0 HG23 VAL A 67 63.626 -29.282 5.880 1.00 55.33 H new ATOM 957 N ARG A 68 62.543 -32.044 6.445 1.00 40.25 N ATOM 958 CA ARG A 68 61.172 -31.985 6.936 1.00 51.34 C ATOM 959 C ARG A 68 60.933 -30.706 7.731 1.00 33.21 C ATOM 960 O ARG A 68 61.817 -30.232 8.447 1.00 55.20 O ATOM 961 CB ARG A 68 60.867 -33.206 7.806 1.00 2.34 C ATOM 962 CG ARG A 68 59.934 -32.906 8.969 1.00 24.50 C ATOM 963 CD ARG A 68 59.351 -34.181 9.559 1.00 64.22 C ATOM 964 NE ARG A 68 60.171 -34.704 10.648 1.00 11.01 N ATOM 965 CZ ARG A 68 59.727 -35.570 11.552 1.00 5.41 C ATOM 966 NH1 ARG A 68 58.476 -36.008 11.496 1.00 24.14 N ATOM 967 NH2 ARG A 68 60.533 -36.000 12.514 1.00 44.35 N ATOM 0 H ARG A 68 63.210 -32.446 7.104 1.00 40.25 H new ATOM 0 HA ARG A 68 60.504 -31.985 6.075 1.00 51.34 H new ATOM 0 HB2 ARG A 68 60.421 -33.983 7.184 1.00 2.34 H new ATOM 0 HB3 ARG A 68 61.803 -33.607 8.196 1.00 2.34 H new ATOM 0 HG2 ARG A 68 60.477 -32.362 9.741 1.00 24.50 H new ATOM 0 HG3 ARG A 68 59.126 -32.258 8.631 1.00 24.50 H new ATOM 0 HD2 ARG A 68 58.344 -33.983 9.926 1.00 64.22 H new ATOM 0 HD3 ARG A 68 59.263 -34.935 8.777 1.00 64.22 H new ATOM 0 HE ARG A 68 61.138 -34.387 10.718 1.00 11.01 H new ATOM 0 HH11 ARG A 68 57.853 -35.680 10.758 1.00 24.14 H new ATOM 0 HH12 ARG A 68 58.137 -36.673 12.191 1.00 24.14 H new ATOM 0 HH21 ARG A 68 61.495 -35.666 12.560 1.00 44.35 H new ATOM 0 HH22 ARG A 68 60.190 -36.665 13.207 1.00 44.35 H new ATOM 981 N THR A 69 59.732 -30.150 7.603 1.00 43.04 N ATOM 982 CA THR A 69 59.377 -28.924 8.307 1.00 74.53 C ATOM 983 C THR A 69 59.816 -28.984 9.767 1.00 1.33 C ATOM 984 O THR A 69 60.422 -28.045 10.282 1.00 44.14 O ATOM 985 CB THR A 69 57.861 -28.661 8.248 1.00 35.21 C ATOM 986 OG1 THR A 69 57.518 -27.578 9.119 1.00 23.12 O ATOM 987 CG2 THR A 69 57.080 -29.905 8.646 1.00 70.42 C ATOM 0 H THR A 69 58.988 -30.530 7.018 1.00 43.04 H new ATOM 0 HA THR A 69 59.898 -28.108 7.806 1.00 74.53 H new ATOM 0 HB THR A 69 57.599 -28.399 7.223 1.00 35.21 H new ATOM 0 HG1 THR A 69 56.553 -27.416 9.075 1.00 23.12 H new ATOM 0 HG21 THR A 69 56.012 -29.695 8.597 1.00 70.42 H new ATOM 0 HG22 THR A 69 57.321 -30.720 7.964 1.00 70.42 H new ATOM 0 HG23 THR A 69 57.347 -30.192 9.663 1.00 70.42 H new ATOM 995 N ASP A 70 59.504 -30.093 10.428 1.00 71.55 N ATOM 996 CA ASP A 70 59.868 -30.275 11.828 1.00 54.22 C ATOM 997 C ASP A 70 61.355 -30.016 12.042 1.00 34.11 C ATOM 998 O ASP A 70 61.739 -29.223 12.902 1.00 41.31 O ATOM 999 CB ASP A 70 59.513 -31.691 12.289 1.00 10.01 C ATOM 1000 CG ASP A 70 59.762 -31.896 13.770 1.00 75.13 C ATOM 1001 OD1 ASP A 70 59.303 -31.055 14.571 1.00 52.12 O ATOM 1002 OD2 ASP A 70 60.415 -32.898 14.129 1.00 73.03 O ATOM 0 H ASP A 70 59.000 -30.879 10.017 1.00 71.55 H new ATOM 0 HA ASP A 70 59.304 -29.555 12.421 1.00 54.22 H new ATOM 0 HB2 ASP A 70 58.464 -31.890 12.069 1.00 10.01 H new ATOM 0 HB3 ASP A 70 60.100 -32.413 11.721 1.00 10.01 H new ATOM 1007 N GLU A 71 62.188 -30.690 11.256 1.00 53.22 N ATOM 1008 CA GLU A 71 63.634 -30.532 11.362 1.00 75.24 C ATOM 1009 C GLU A 71 64.032 -29.064 11.238 1.00 73.01 C ATOM 1010 O GLU A 71 64.927 -28.592 11.939 1.00 23.14 O ATOM 1011 CB GLU A 71 64.339 -31.356 10.281 1.00 73.51 C ATOM 1012 CG GLU A 71 63.970 -32.829 10.301 1.00 12.52 C ATOM 1013 CD GLU A 71 64.187 -33.468 11.658 1.00 61.33 C ATOM 1014 OE1 GLU A 71 65.137 -33.060 12.359 1.00 23.10 O ATOM 1015 OE2 GLU A 71 63.411 -34.376 12.020 1.00 42.22 O ATOM 0 H GLU A 71 61.887 -31.350 10.539 1.00 53.22 H new ATOM 0 HA GLU A 71 63.942 -30.892 12.343 1.00 75.24 H new ATOM 0 HB2 GLU A 71 64.094 -30.942 9.303 1.00 73.51 H new ATOM 0 HB3 GLU A 71 65.417 -31.259 10.407 1.00 73.51 H new ATOM 0 HG2 GLU A 71 62.924 -32.941 10.014 1.00 12.52 H new ATOM 0 HG3 GLU A 71 64.564 -33.358 9.556 1.00 12.52 H new ATOM 1022 N VAL A 72 63.361 -28.349 10.342 1.00 0.10 N ATOM 1023 CA VAL A 72 63.642 -26.935 10.126 1.00 72.10 C ATOM 1024 C VAL A 72 63.116 -26.087 11.278 1.00 34.53 C ATOM 1025 O VAL A 72 63.756 -25.121 11.696 1.00 74.22 O ATOM 1026 CB VAL A 72 63.021 -26.433 8.809 1.00 64.41 C ATOM 1027 CG1 VAL A 72 63.623 -25.095 8.411 1.00 65.14 C ATOM 1028 CG2 VAL A 72 63.209 -27.462 7.705 1.00 71.54 C ATOM 0 H VAL A 72 62.618 -28.726 9.753 1.00 0.10 H new ATOM 0 HA VAL A 72 64.726 -26.834 10.070 1.00 72.10 H new ATOM 0 HB VAL A 72 61.951 -26.291 8.963 1.00 64.41 H new ATOM 0 HG11 VAL A 72 63.172 -24.756 7.478 1.00 65.14 H new ATOM 0 HG12 VAL A 72 63.430 -24.362 9.194 1.00 65.14 H new ATOM 0 HG13 VAL A 72 64.699 -25.206 8.275 1.00 65.14 H new ATOM 0 HG21 VAL A 72 62.764 -27.091 6.782 1.00 71.54 H new ATOM 0 HG22 VAL A 72 64.273 -27.639 7.550 1.00 71.54 H new ATOM 0 HG23 VAL A 72 62.724 -28.395 7.991 1.00 71.54 H new ATOM 1038 N ARG A 73 61.946 -26.456 11.792 1.00 42.24 N ATOM 1039 CA ARG A 73 61.334 -25.729 12.896 1.00 14.43 C ATOM 1040 C ARG A 73 62.284 -25.646 14.086 1.00 20.31 C ATOM 1041 O ARG A 73 62.372 -24.613 14.750 1.00 73.44 O ATOM 1042 CB ARG A 73 60.029 -26.407 13.319 1.00 4.22 C ATOM 1043 CG ARG A 73 59.240 -25.619 14.353 1.00 52.42 C ATOM 1044 CD ARG A 73 59.653 -25.990 15.769 1.00 60.01 C ATOM 1045 NE ARG A 73 58.583 -25.746 16.732 1.00 4.13 N ATOM 1046 CZ ARG A 73 58.629 -26.144 17.998 1.00 73.22 C ATOM 1047 NH1 ARG A 73 59.688 -26.802 18.451 1.00 74.12 N ATOM 1048 NH2 ARG A 73 57.616 -25.885 18.814 1.00 21.34 N ATOM 0 H ARG A 73 61.404 -27.254 11.461 1.00 42.24 H new ATOM 0 HA ARG A 73 61.117 -24.717 12.555 1.00 14.43 H new ATOM 0 HB2 ARG A 73 59.406 -26.559 12.438 1.00 4.22 H new ATOM 0 HB3 ARG A 73 60.256 -27.394 13.723 1.00 4.22 H new ATOM 0 HG2 ARG A 73 59.395 -24.552 14.195 1.00 52.42 H new ATOM 0 HG3 ARG A 73 58.175 -25.809 14.222 1.00 52.42 H new ATOM 0 HD2 ARG A 73 59.936 -27.042 15.800 1.00 60.01 H new ATOM 0 HD3 ARG A 73 60.534 -25.414 16.052 1.00 60.01 H new ATOM 0 HE ARG A 73 57.755 -25.242 16.415 1.00 4.13 H new ATOM 0 HH11 ARG A 73 60.469 -27.003 17.827 1.00 74.12 H new ATOM 0 HH12 ARG A 73 59.721 -27.107 19.424 1.00 74.12 H new ATOM 0 HH21 ARG A 73 56.800 -25.379 18.469 1.00 21.34 H new ATOM 0 HH22 ARG A 73 57.653 -26.191 19.786 1.00 21.34 H new ATOM 1062 N GLN A 74 62.992 -26.739 14.350 1.00 43.21 N ATOM 1063 CA GLN A 74 63.935 -26.789 15.460 1.00 32.13 C ATOM 1064 C GLN A 74 64.915 -25.623 15.396 1.00 23.13 C ATOM 1065 O GLN A 74 65.459 -25.197 16.416 1.00 11.50 O ATOM 1066 CB GLN A 74 64.700 -28.114 15.448 1.00 71.24 C ATOM 1067 CG GLN A 74 63.876 -29.297 15.929 1.00 35.01 C ATOM 1068 CD GLN A 74 64.322 -30.608 15.313 1.00 61.54 C ATOM 1069 OE1 GLN A 74 65.388 -30.689 14.701 1.00 21.51 O ATOM 1070 NE2 GLN A 74 63.508 -31.645 15.471 1.00 1.40 N ATOM 0 H GLN A 74 62.930 -27.602 13.810 1.00 43.21 H new ATOM 0 HA GLN A 74 63.368 -26.713 16.388 1.00 32.13 H new ATOM 0 HB2 GLN A 74 65.049 -28.313 14.435 1.00 71.24 H new ATOM 0 HB3 GLN A 74 65.585 -28.019 16.077 1.00 71.24 H new ATOM 0 HG2 GLN A 74 63.947 -29.367 17.014 1.00 35.01 H new ATOM 0 HG3 GLN A 74 62.827 -29.126 15.689 1.00 35.01 H new ATOM 0 HE21 GLN A 74 62.634 -31.534 15.985 1.00 1.40 H new ATOM 0 HE22 GLN A 74 63.756 -32.553 15.078 1.00 1.40 H new ATOM 1079 N LEU A 75 65.136 -25.109 14.191 1.00 25.23 N ATOM 1080 CA LEU A 75 66.051 -23.989 13.992 1.00 33.32 C ATOM 1081 C LEU A 75 65.308 -22.764 13.472 1.00 4.35 C ATOM 1082 O LEU A 75 64.077 -22.713 13.499 1.00 62.30 O ATOM 1083 CB LEU A 75 67.162 -24.379 13.016 1.00 52.30 C ATOM 1084 CG LEU A 75 67.860 -25.712 13.291 1.00 3.55 C ATOM 1085 CD1 LEU A 75 67.093 -26.858 12.649 1.00 33.10 C ATOM 1086 CD2 LEU A 75 69.294 -25.677 12.785 1.00 42.31 C ATOM 0 H LEU A 75 64.694 -25.449 13.337 1.00 25.23 H new ATOM 0 HA LEU A 75 66.494 -23.739 14.956 1.00 33.32 H new ATOM 0 HB2 LEU A 75 66.740 -24.413 12.011 1.00 52.30 H new ATOM 0 HB3 LEU A 75 67.914 -23.590 13.019 1.00 52.30 H new ATOM 0 HG LEU A 75 67.881 -25.875 14.369 1.00 3.55 H new ATOM 0 HD11 LEU A 75 67.604 -27.798 12.855 1.00 33.10 H new ATOM 0 HD12 LEU A 75 66.084 -26.896 13.060 1.00 33.10 H new ATOM 0 HD13 LEU A 75 67.040 -26.702 11.571 1.00 33.10 H new ATOM 0 HD21 LEU A 75 69.775 -26.633 12.989 1.00 42.31 H new ATOM 0 HD22 LEU A 75 69.296 -25.491 11.711 1.00 42.31 H new ATOM 0 HD23 LEU A 75 69.839 -24.881 13.292 1.00 42.31 H new ATOM 1098 N ARG A 76 66.062 -21.779 12.995 1.00 23.44 N ATOM 1099 CA ARG A 76 65.474 -20.553 12.466 1.00 52.01 C ATOM 1100 C ARG A 76 65.700 -20.448 10.961 1.00 3.01 C ATOM 1101 O ARG A 76 66.287 -21.339 10.347 1.00 54.31 O ATOM 1102 CB ARG A 76 66.070 -19.332 13.170 1.00 44.51 C ATOM 1103 CG ARG A 76 67.539 -19.105 12.855 1.00 62.35 C ATOM 1104 CD ARG A 76 67.992 -17.717 13.278 1.00 72.21 C ATOM 1105 NE ARG A 76 68.696 -17.019 12.206 1.00 61.25 N ATOM 1106 CZ ARG A 76 69.151 -15.776 12.312 1.00 74.34 C ATOM 1107 NH1 ARG A 76 68.978 -15.097 13.438 1.00 11.51 N ATOM 1108 NH2 ARG A 76 69.782 -15.209 11.292 1.00 73.22 N ATOM 0 H ARG A 76 67.081 -21.806 12.964 1.00 23.44 H new ATOM 0 HA ARG A 76 64.401 -20.583 12.653 1.00 52.01 H new ATOM 0 HB2 ARG A 76 65.504 -18.446 12.883 1.00 44.51 H new ATOM 0 HB3 ARG A 76 65.952 -19.451 14.247 1.00 44.51 H new ATOM 0 HG2 ARG A 76 68.142 -19.857 13.365 1.00 62.35 H new ATOM 0 HG3 ARG A 76 67.707 -19.233 11.786 1.00 62.35 H new ATOM 0 HD2 ARG A 76 67.125 -17.131 13.584 1.00 72.21 H new ATOM 0 HD3 ARG A 76 68.645 -17.798 14.147 1.00 72.21 H new ATOM 0 HE ARG A 76 68.847 -17.514 11.327 1.00 61.25 H new ATOM 0 HH11 ARG A 76 68.495 -15.529 14.225 1.00 11.51 H new ATOM 0 HH12 ARG A 76 69.328 -14.142 13.517 1.00 11.51 H new ATOM 0 HH21 ARG A 76 69.918 -15.728 10.425 1.00 73.22 H new ATOM 0 HH22 ARG A 76 70.131 -14.254 11.375 1.00 73.22 H new ATOM 1122 N ARG A 77 65.229 -19.353 10.372 1.00 72.31 N ATOM 1123 CA ARG A 77 65.378 -19.132 8.940 1.00 63.23 C ATOM 1124 C ARG A 77 66.805 -18.710 8.599 1.00 71.32 C ATOM 1125 O ARG A 77 67.331 -17.751 9.163 1.00 21.20 O ATOM 1126 CB ARG A 77 64.392 -18.065 8.461 1.00 22.34 C ATOM 1127 CG ARG A 77 62.946 -18.530 8.454 1.00 54.53 C ATOM 1128 CD ARG A 77 62.099 -17.733 9.432 1.00 10.42 C ATOM 1129 NE ARG A 77 60.721 -17.586 8.969 1.00 20.30 N ATOM 1130 CZ ARG A 77 59.775 -16.961 9.662 1.00 23.51 C ATOM 1131 NH1 ARG A 77 60.058 -16.426 10.842 1.00 31.21 N ATOM 1132 NH2 ARG A 77 58.545 -16.868 9.173 1.00 33.41 N ATOM 0 H ARG A 77 64.741 -18.606 10.866 1.00 72.31 H new ATOM 0 HA ARG A 77 65.163 -20.071 8.430 1.00 63.23 H new ATOM 0 HB2 ARG A 77 64.479 -17.188 9.102 1.00 22.34 H new ATOM 0 HB3 ARG A 77 64.669 -17.753 7.454 1.00 22.34 H new ATOM 0 HG2 ARG A 77 62.535 -18.429 7.449 1.00 54.53 H new ATOM 0 HG3 ARG A 77 62.902 -19.588 8.712 1.00 54.53 H new ATOM 0 HD2 ARG A 77 62.104 -18.228 10.403 1.00 10.42 H new ATOM 0 HD3 ARG A 77 62.541 -16.747 9.574 1.00 10.42 H new ATOM 0 HE ARG A 77 60.471 -17.985 8.064 1.00 20.30 H new ATOM 0 HH11 ARG A 77 61.003 -16.494 11.219 1.00 31.21 H new ATOM 0 HH12 ARG A 77 59.330 -15.947 11.372 1.00 31.21 H new ATOM 0 HH21 ARG A 77 58.325 -17.276 8.265 1.00 33.41 H new ATOM 0 HH22 ARG A 77 57.819 -16.388 9.706 1.00 33.41 H new ATOM 1146 N GLY A 78 67.427 -19.435 7.674 1.00 15.31 N ATOM 1147 CA GLY A 78 68.786 -19.122 7.276 1.00 2.00 C ATOM 1148 C GLY A 78 69.808 -20.019 7.946 1.00 11.13 C ATOM 1149 O GLY A 78 70.973 -19.648 8.085 1.00 34.42 O ATOM 0 H GLY A 78 67.013 -20.234 7.193 1.00 15.31 H new ATOM 0 HA2 GLY A 78 68.876 -19.219 6.194 1.00 2.00 H new ATOM 0 HA3 GLY A 78 69.003 -18.082 7.522 1.00 2.00 H new ATOM 1153 N ASP A 79 69.371 -21.202 8.363 1.00 51.33 N ATOM 1154 CA ASP A 79 70.256 -22.156 9.022 1.00 3.25 C ATOM 1155 C ASP A 79 71.052 -22.957 7.998 1.00 52.45 C ATOM 1156 O ASP A 79 70.502 -23.801 7.290 1.00 43.42 O ATOM 1157 CB ASP A 79 69.449 -23.102 9.912 1.00 32.53 C ATOM 1158 CG ASP A 79 69.385 -22.629 11.352 1.00 73.02 C ATOM 1159 OD1 ASP A 79 68.467 -21.850 11.680 1.00 2.21 O ATOM 1160 OD2 ASP A 79 70.255 -23.038 12.150 1.00 22.34 O ATOM 0 H ASP A 79 68.409 -21.524 8.256 1.00 51.33 H new ATOM 0 HA ASP A 79 70.956 -21.596 9.641 1.00 3.25 H new ATOM 0 HB2 ASP A 79 68.437 -23.193 9.517 1.00 32.53 H new ATOM 0 HB3 ASP A 79 69.895 -24.096 9.879 1.00 32.53 H new ATOM 1165 N THR A 80 72.352 -22.687 7.923 1.00 33.21 N ATOM 1166 CA THR A 80 73.224 -23.381 6.984 1.00 71.34 C ATOM 1167 C THR A 80 73.785 -24.660 7.596 1.00 64.11 C ATOM 1168 O THR A 80 74.622 -24.612 8.499 1.00 15.30 O ATOM 1169 CB THR A 80 74.393 -22.485 6.535 1.00 24.21 C ATOM 1170 OG1 THR A 80 75.428 -23.284 5.952 1.00 44.42 O ATOM 1171 CG2 THR A 80 74.954 -21.699 7.711 1.00 63.33 C ATOM 0 H THR A 80 72.824 -21.992 8.502 1.00 33.21 H new ATOM 0 HA THR A 80 72.615 -23.634 6.116 1.00 71.34 H new ATOM 0 HB THR A 80 74.017 -21.781 5.793 1.00 24.21 H new ATOM 0 HG1 THR A 80 75.898 -22.762 5.269 1.00 44.42 H new ATOM 0 HG21 THR A 80 75.779 -21.073 7.370 1.00 63.33 H new ATOM 0 HG22 THR A 80 74.171 -21.069 8.134 1.00 63.33 H new ATOM 0 HG23 THR A 80 75.314 -22.391 8.472 1.00 63.33 H new ATOM 1179 N LEU A 81 73.321 -25.800 7.100 1.00 55.44 N ATOM 1180 CA LEU A 81 73.777 -27.094 7.597 1.00 31.01 C ATOM 1181 C LEU A 81 74.883 -27.660 6.711 1.00 25.25 C ATOM 1182 O LEU A 81 74.780 -27.643 5.485 1.00 54.43 O ATOM 1183 CB LEU A 81 72.608 -28.078 7.664 1.00 34.02 C ATOM 1184 CG LEU A 81 71.567 -27.961 6.551 1.00 44.40 C ATOM 1185 CD1 LEU A 81 70.674 -26.752 6.781 1.00 42.12 C ATOM 1186 CD2 LEU A 81 72.247 -27.873 5.191 1.00 35.42 C ATOM 0 H LEU A 81 72.628 -25.856 6.353 1.00 55.44 H new ATOM 0 HA LEU A 81 74.179 -26.948 8.600 1.00 31.01 H new ATOM 0 HB2 LEU A 81 73.011 -29.091 7.652 1.00 34.02 H new ATOM 0 HB3 LEU A 81 72.103 -27.947 8.621 1.00 34.02 H new ATOM 0 HG LEU A 81 70.944 -28.856 6.567 1.00 44.40 H new ATOM 0 HD11 LEU A 81 69.939 -26.685 5.979 1.00 42.12 H new ATOM 0 HD12 LEU A 81 70.160 -26.856 7.736 1.00 42.12 H new ATOM 0 HD13 LEU A 81 71.282 -25.847 6.793 1.00 42.12 H new ATOM 0 HD21 LEU A 81 71.491 -27.790 4.411 1.00 35.42 H new ATOM 0 HD22 LEU A 81 72.894 -26.996 5.164 1.00 35.42 H new ATOM 0 HD23 LEU A 81 72.844 -28.770 5.024 1.00 35.42 H new ATOM 1198 N THR A 82 75.941 -28.160 7.341 1.00 70.22 N ATOM 1199 CA THR A 82 77.065 -28.731 6.612 1.00 40.45 C ATOM 1200 C THR A 82 76.896 -30.235 6.429 1.00 13.12 C ATOM 1201 O THR A 82 77.133 -31.013 7.354 1.00 13.41 O ATOM 1202 CB THR A 82 78.399 -28.461 7.332 1.00 72.12 C ATOM 1203 OG1 THR A 82 79.469 -29.123 6.649 1.00 41.32 O ATOM 1204 CG2 THR A 82 78.341 -28.938 8.776 1.00 53.23 C ATOM 0 H THR A 82 76.042 -28.181 8.356 1.00 70.22 H new ATOM 0 HA THR A 82 77.084 -28.248 5.635 1.00 40.45 H new ATOM 0 HB THR A 82 78.577 -27.386 7.327 1.00 72.12 H new ATOM 0 HG1 THR A 82 80.313 -28.944 7.113 1.00 41.32 H new ATOM 0 HG21 THR A 82 79.295 -28.737 9.264 1.00 53.23 H new ATOM 0 HG22 THR A 82 77.545 -28.410 9.302 1.00 53.23 H new ATOM 0 HG23 THR A 82 78.141 -30.009 8.798 1.00 53.23 H new ATOM 1212 N ILE A 83 76.484 -30.638 5.232 1.00 50.55 N ATOM 1213 CA ILE A 83 76.284 -32.050 4.929 1.00 40.34 C ATOM 1214 C ILE A 83 76.928 -32.423 3.597 1.00 32.14 C ATOM 1215 O ILE A 83 76.720 -31.753 2.586 1.00 3.22 O ATOM 1216 CB ILE A 83 74.788 -32.409 4.880 1.00 35.23 C ATOM 1217 CG1 ILE A 83 74.426 -33.003 3.517 1.00 74.12 C ATOM 1218 CG2 ILE A 83 73.939 -31.181 5.171 1.00 33.25 C ATOM 1219 CD1 ILE A 83 74.125 -31.960 2.465 1.00 23.04 C ATOM 0 H ILE A 83 76.282 -30.007 4.456 1.00 50.55 H new ATOM 0 HA ILE A 83 76.759 -32.615 5.731 1.00 40.34 H new ATOM 0 HB ILE A 83 74.585 -33.157 5.646 1.00 35.23 H new ATOM 0 HG12 ILE A 83 75.249 -33.628 3.172 1.00 74.12 H new ATOM 0 HG13 ILE A 83 73.558 -33.653 3.632 1.00 74.12 H new ATOM 0 HG21 ILE A 83 72.884 -31.451 5.133 1.00 33.25 H new ATOM 0 HG22 ILE A 83 74.180 -30.799 6.163 1.00 33.25 H new ATOM 0 HG23 ILE A 83 74.144 -30.412 4.426 1.00 33.25 H new ATOM 0 HD11 ILE A 83 73.877 -32.453 1.525 1.00 23.04 H new ATOM 0 HD12 ILE A 83 73.282 -31.349 2.789 1.00 23.04 H new ATOM 0 HD13 ILE A 83 74.999 -31.325 2.322 1.00 23.04 H new ATOM 1231 N GLY A 84 77.709 -33.499 3.604 1.00 44.12 N ATOM 1232 CA GLY A 84 78.370 -33.944 2.391 1.00 23.30 C ATOM 1233 C GLY A 84 79.482 -33.007 1.960 1.00 45.54 C ATOM 1234 O GLY A 84 80.646 -33.400 1.906 1.00 75.03 O ATOM 0 H GLY A 84 77.896 -34.070 4.428 1.00 44.12 H new ATOM 0 HA2 GLY A 84 78.780 -34.941 2.549 1.00 23.30 H new ATOM 0 HA3 GLY A 84 77.636 -34.025 1.589 1.00 23.30 H new ATOM 1238 N GLU A 85 79.121 -31.766 1.649 1.00 44.11 N ATOM 1239 CA GLU A 85 80.098 -30.772 1.218 1.00 51.33 C ATOM 1240 C GLU A 85 80.417 -29.797 2.347 1.00 2.34 C ATOM 1241 O GLU A 85 81.420 -29.945 3.042 1.00 24.53 O ATOM 1242 CB GLU A 85 79.576 -30.008 -0.001 1.00 30.34 C ATOM 1243 CG GLU A 85 80.563 -28.991 -0.550 1.00 75.45 C ATOM 1244 CD GLU A 85 81.821 -29.638 -1.096 1.00 72.30 C ATOM 1245 OE1 GLU A 85 81.816 -30.044 -2.277 1.00 63.42 O ATOM 1246 OE2 GLU A 85 82.812 -29.737 -0.342 1.00 70.30 O ATOM 0 H GLU A 85 78.160 -31.425 1.687 1.00 44.11 H new ATOM 0 HA GLU A 85 81.015 -31.295 0.945 1.00 51.33 H new ATOM 0 HB2 GLU A 85 79.327 -30.721 -0.787 1.00 30.34 H new ATOM 0 HB3 GLU A 85 78.652 -29.496 0.270 1.00 30.34 H new ATOM 0 HG2 GLU A 85 80.083 -28.414 -1.340 1.00 75.45 H new ATOM 0 HG3 GLU A 85 80.833 -28.289 0.239 1.00 75.45 H new ATOM 1253 N GLU A 86 79.555 -28.800 2.521 1.00 1.34 N ATOM 1254 CA GLU A 86 79.745 -27.799 3.564 1.00 73.43 C ATOM 1255 C GLU A 86 78.408 -27.210 4.004 1.00 51.30 C ATOM 1256 O GLU A 86 77.411 -27.304 3.289 1.00 52.32 O ATOM 1257 CB GLU A 86 80.669 -26.684 3.069 1.00 1.34 C ATOM 1258 CG GLU A 86 82.050 -27.171 2.666 1.00 72.14 C ATOM 1259 CD GLU A 86 82.949 -26.046 2.190 1.00 35.54 C ATOM 1260 OE1 GLU A 86 82.423 -24.955 1.888 1.00 43.41 O ATOM 1261 OE2 GLU A 86 84.177 -26.257 2.121 1.00 71.32 O ATOM 0 H GLU A 86 78.719 -28.664 1.953 1.00 1.34 H new ATOM 0 HA GLU A 86 80.206 -28.289 4.422 1.00 73.43 H new ATOM 0 HB2 GLU A 86 80.204 -26.191 2.216 1.00 1.34 H new ATOM 0 HB3 GLU A 86 80.772 -25.934 3.853 1.00 1.34 H new ATOM 0 HG2 GLU A 86 82.517 -27.670 3.515 1.00 72.14 H new ATOM 0 HG3 GLU A 86 81.953 -27.913 1.874 1.00 72.14 H new ATOM 1268 N ASN A 87 78.396 -26.603 5.186 1.00 31.22 N ATOM 1269 CA ASN A 87 77.181 -26.000 5.723 1.00 60.32 C ATOM 1270 C ASN A 87 76.545 -25.059 4.705 1.00 41.43 C ATOM 1271 O ASN A 87 77.190 -24.135 4.210 1.00 1.13 O ATOM 1272 CB ASN A 87 77.493 -25.237 7.013 1.00 51.53 C ATOM 1273 CG ASN A 87 78.853 -24.567 6.974 1.00 31.11 C ATOM 1274 OD1 ASN A 87 79.887 -25.234 6.998 1.00 41.44 O ATOM 1275 ND2 ASN A 87 78.857 -23.241 6.914 1.00 1.01 N ATOM 0 H ASN A 87 79.213 -26.515 5.790 1.00 31.22 H new ATOM 0 HA ASN A 87 76.475 -26.800 5.943 1.00 60.32 H new ATOM 0 HB2 ASN A 87 76.724 -24.483 7.181 1.00 51.53 H new ATOM 0 HB3 ASN A 87 77.454 -25.925 7.857 1.00 51.53 H new ATOM 0 HD21 ASN A 87 79.742 -22.734 6.886 1.00 1.01 H new ATOM 0 HD22 ASN A 87 77.975 -22.729 6.896 1.00 1.01 H new ATOM 1282 N PHE A 88 75.276 -25.302 4.395 1.00 12.15 N ATOM 1283 CA PHE A 88 74.552 -24.477 3.436 1.00 4.20 C ATOM 1284 C PHE A 88 73.182 -24.084 3.980 1.00 12.45 C ATOM 1285 O PHE A 88 72.352 -24.943 4.282 1.00 72.24 O ATOM 1286 CB PHE A 88 74.391 -25.223 2.109 1.00 71.31 C ATOM 1287 CG PHE A 88 75.684 -25.751 1.558 1.00 33.40 C ATOM 1288 CD1 PHE A 88 76.837 -24.984 1.604 1.00 44.22 C ATOM 1289 CD2 PHE A 88 75.747 -27.015 0.993 1.00 33.34 C ATOM 1290 CE1 PHE A 88 78.029 -25.467 1.098 1.00 41.34 C ATOM 1291 CE2 PHE A 88 76.936 -27.504 0.486 1.00 74.42 C ATOM 1292 CZ PHE A 88 78.078 -26.729 0.538 1.00 2.01 C ATOM 0 H PHE A 88 74.728 -26.064 4.794 1.00 12.15 H new ATOM 0 HA PHE A 88 75.130 -23.569 3.267 1.00 4.20 H new ATOM 0 HB2 PHE A 88 73.699 -26.053 2.250 1.00 71.31 H new ATOM 0 HB3 PHE A 88 73.940 -24.553 1.377 1.00 71.31 H new ATOM 0 HD1 PHE A 88 76.804 -23.997 2.041 1.00 44.22 H new ATOM 0 HD2 PHE A 88 74.857 -27.625 0.948 1.00 33.34 H new ATOM 0 HE1 PHE A 88 78.921 -24.859 1.140 1.00 41.34 H new ATOM 0 HE2 PHE A 88 76.972 -28.491 0.050 1.00 74.42 H new ATOM 0 HZ PHE A 88 79.008 -27.109 0.141 1.00 2.01 H new ATOM 1302 N TRP A 89 72.952 -22.782 4.103 1.00 2.31 N ATOM 1303 CA TRP A 89 71.683 -22.275 4.611 1.00 14.14 C ATOM 1304 C TRP A 89 70.616 -22.283 3.522 1.00 61.51 C ATOM 1305 O TRP A 89 70.880 -21.907 2.379 1.00 64.43 O ATOM 1306 CB TRP A 89 71.859 -20.858 5.160 1.00 50.15 C ATOM 1307 CG TRP A 89 72.390 -19.891 4.146 1.00 42.14 C ATOM 1308 CD1 TRP A 89 71.729 -19.400 3.056 1.00 52.10 C ATOM 1309 CD2 TRP A 89 73.693 -19.298 4.126 1.00 54.45 C ATOM 1310 NE1 TRP A 89 72.543 -18.540 2.360 1.00 1.24 N ATOM 1311 CE2 TRP A 89 73.752 -18.459 2.997 1.00 64.33 C ATOM 1312 CE3 TRP A 89 74.815 -19.393 4.954 1.00 52.25 C ATOM 1313 CZ2 TRP A 89 74.889 -17.722 2.676 1.00 60.50 C ATOM 1314 CZ3 TRP A 89 75.943 -18.662 4.634 1.00 52.43 C ATOM 1315 CH2 TRP A 89 75.973 -17.835 3.504 1.00 42.23 C ATOM 0 H TRP A 89 73.628 -22.058 3.858 1.00 2.31 H new ATOM 0 HA TRP A 89 71.356 -22.932 5.417 1.00 14.14 H new ATOM 0 HB2 TRP A 89 70.899 -20.497 5.528 1.00 50.15 H new ATOM 0 HB3 TRP A 89 72.537 -20.888 6.013 1.00 50.15 H new ATOM 0 HD1 TRP A 89 70.715 -19.651 2.782 1.00 52.10 H new ATOM 0 HE1 TRP A 89 72.288 -18.042 1.507 1.00 1.24 H new ATOM 0 HE3 TRP A 89 74.801 -20.027 5.828 1.00 52.25 H new ATOM 0 HZ2 TRP A 89 74.915 -17.084 1.805 1.00 60.50 H new ATOM 0 HZ3 TRP A 89 76.816 -18.729 5.266 1.00 52.43 H new ATOM 0 HH2 TRP A 89 76.869 -17.275 3.282 1.00 42.23 H new ATOM 1326 N VAL A 90 69.411 -22.713 3.881 1.00 3.35 N ATOM 1327 CA VAL A 90 68.304 -22.767 2.933 1.00 62.44 C ATOM 1328 C VAL A 90 67.524 -21.458 2.923 1.00 31.24 C ATOM 1329 O VAL A 90 67.229 -20.891 3.975 1.00 23.34 O ATOM 1330 CB VAL A 90 67.342 -23.924 3.261 1.00 30.23 C ATOM 1331 CG1 VAL A 90 66.580 -23.637 4.547 1.00 45.44 C ATOM 1332 CG2 VAL A 90 66.382 -24.161 2.105 1.00 22.23 C ATOM 0 H VAL A 90 69.176 -23.029 4.822 1.00 3.35 H new ATOM 0 HA VAL A 90 68.738 -22.934 1.947 1.00 62.44 H new ATOM 0 HB VAL A 90 67.928 -24.831 3.409 1.00 30.23 H new ATOM 0 HG11 VAL A 90 65.905 -24.465 4.763 1.00 45.44 H new ATOM 0 HG12 VAL A 90 67.286 -23.520 5.370 1.00 45.44 H new ATOM 0 HG13 VAL A 90 66.003 -22.720 4.431 1.00 45.44 H new ATOM 0 HG21 VAL A 90 65.709 -24.982 2.353 1.00 22.23 H new ATOM 0 HG22 VAL A 90 65.800 -23.257 1.924 1.00 22.23 H new ATOM 0 HG23 VAL A 90 66.948 -24.414 1.208 1.00 22.23 H new ATOM 1342 N ASP A 91 67.193 -20.983 1.728 1.00 11.32 N ATOM 1343 CA ASP A 91 66.444 -19.740 1.580 1.00 42.33 C ATOM 1344 C ASP A 91 65.049 -19.870 2.183 1.00 72.12 C ATOM 1345 O ASP A 91 64.736 -19.236 3.191 1.00 42.53 O ATOM 1346 CB ASP A 91 66.340 -19.355 0.103 1.00 51.10 C ATOM 1347 CG ASP A 91 64.993 -18.752 -0.245 1.00 62.11 C ATOM 1348 OD1 ASP A 91 64.728 -17.609 0.180 1.00 45.01 O ATOM 1349 OD2 ASP A 91 64.204 -19.424 -0.942 1.00 73.20 O ATOM 0 H ASP A 91 67.431 -21.439 0.847 1.00 11.32 H new ATOM 0 HA ASP A 91 66.980 -18.956 2.116 1.00 42.33 H new ATOM 0 HB2 ASP A 91 67.128 -18.642 -0.140 1.00 51.10 H new ATOM 0 HB3 ASP A 91 66.509 -20.239 -0.513 1.00 51.10 H new ATOM 1354 N ARG A 92 64.214 -20.696 1.560 1.00 60.44 N ATOM 1355 CA ARG A 92 62.853 -20.908 2.034 1.00 12.40 C ATOM 1356 C ARG A 92 62.258 -22.178 1.431 1.00 61.31 C ATOM 1357 O ARG A 92 62.180 -22.321 0.212 1.00 52.31 O ATOM 1358 CB ARG A 92 61.975 -19.704 1.683 1.00 75.24 C ATOM 1359 CG ARG A 92 60.507 -19.901 2.026 1.00 50.44 C ATOM 1360 CD ARG A 92 59.819 -18.576 2.311 1.00 23.50 C ATOM 1361 NE ARG A 92 59.847 -18.240 3.733 1.00 13.13 N ATOM 1362 CZ ARG A 92 59.030 -18.779 4.630 1.00 12.55 C ATOM 1363 NH1 ARG A 92 58.125 -19.675 4.257 1.00 44.35 N ATOM 1364 NH2 ARG A 92 59.115 -18.423 5.906 1.00 55.22 N ATOM 0 H ARG A 92 64.457 -21.229 0.725 1.00 60.44 H new ATOM 0 HA ARG A 92 62.886 -21.022 3.117 1.00 12.40 H new ATOM 0 HB2 ARG A 92 62.348 -18.826 2.211 1.00 75.24 H new ATOM 0 HB3 ARG A 92 62.066 -19.497 0.617 1.00 75.24 H new ATOM 0 HG2 ARG A 92 60.004 -20.403 1.200 1.00 50.44 H new ATOM 0 HG3 ARG A 92 60.420 -20.552 2.896 1.00 50.44 H new ATOM 0 HD2 ARG A 92 60.306 -17.784 1.742 1.00 23.50 H new ATOM 0 HD3 ARG A 92 58.785 -18.624 1.970 1.00 23.50 H new ATOM 0 HE ARG A 92 60.531 -17.555 4.054 1.00 13.13 H new ATOM 0 HH11 ARG A 92 58.055 -19.952 3.278 1.00 44.35 H new ATOM 0 HH12 ARG A 92 57.499 -20.087 4.949 1.00 44.35 H new ATOM 0 HH21 ARG A 92 59.809 -17.735 6.198 1.00 55.22 H new ATOM 0 HH22 ARG A 92 58.487 -18.838 6.594 1.00 55.22 H new ATOM 1378 N VAL A 93 61.842 -23.098 2.296 1.00 2.31 N ATOM 1379 CA VAL A 93 61.254 -24.355 1.849 1.00 33.43 C ATOM 1380 C VAL A 93 59.812 -24.488 2.328 1.00 54.02 C ATOM 1381 O VAL A 93 59.503 -24.206 3.485 1.00 73.13 O ATOM 1382 CB VAL A 93 62.065 -25.564 2.354 1.00 4.14 C ATOM 1383 CG1 VAL A 93 63.510 -25.469 1.890 1.00 43.43 C ATOM 1384 CG2 VAL A 93 61.988 -25.660 3.870 1.00 53.33 C ATOM 0 H VAL A 93 61.901 -22.996 3.309 1.00 2.31 H new ATOM 0 HA VAL A 93 61.272 -24.344 0.759 1.00 33.43 H new ATOM 0 HB VAL A 93 61.633 -26.472 1.933 1.00 4.14 H new ATOM 0 HG11 VAL A 93 64.067 -26.331 2.256 1.00 43.43 H new ATOM 0 HG12 VAL A 93 63.542 -25.452 0.801 1.00 43.43 H new ATOM 0 HG13 VAL A 93 63.958 -24.555 2.280 1.00 43.43 H new ATOM 0 HG21 VAL A 93 62.566 -26.519 4.210 1.00 53.33 H new ATOM 0 HG22 VAL A 93 62.394 -24.751 4.313 1.00 53.33 H new ATOM 0 HG23 VAL A 93 60.948 -25.779 4.175 1.00 53.33 H new ATOM 1394 N SER A 94 58.934 -24.922 1.429 1.00 22.40 N ATOM 1395 CA SER A 94 57.524 -25.089 1.759 1.00 54.32 C ATOM 1396 C SER A 94 57.030 -26.475 1.349 1.00 65.45 C ATOM 1397 O SER A 94 56.785 -26.751 0.174 1.00 31.21 O ATOM 1398 CB SER A 94 56.685 -24.012 1.068 1.00 53.54 C ATOM 1399 OG SER A 94 57.262 -23.632 -0.169 1.00 23.41 O ATOM 0 H SER A 94 59.174 -25.164 0.468 1.00 22.40 H new ATOM 0 HA SER A 94 57.415 -24.987 2.839 1.00 54.32 H new ATOM 0 HB2 SER A 94 55.674 -24.385 0.902 1.00 53.54 H new ATOM 0 HB3 SER A 94 56.601 -23.140 1.717 1.00 53.54 H new ATOM 0 HG SER A 94 56.706 -22.944 -0.592 1.00 23.41 H new ATOM 1405 N PRO A 95 56.884 -27.366 2.339 1.00 74.30 N ATOM 1406 CA PRO A 95 56.420 -28.738 2.107 1.00 62.30 C ATOM 1407 C PRO A 95 54.949 -28.792 1.708 1.00 42.21 C ATOM 1408 O PRO A 95 54.302 -27.758 1.543 1.00 63.12 O ATOM 1409 CB PRO A 95 56.632 -29.418 3.462 1.00 42.04 C ATOM 1410 CG PRO A 95 56.581 -28.308 4.455 1.00 43.34 C ATOM 1411 CD PRO A 95 57.160 -27.105 3.762 1.00 14.11 C ATOM 0 HA PRO A 95 56.955 -29.216 1.287 1.00 62.30 H new ATOM 0 HB2 PRO A 95 55.858 -30.160 3.658 1.00 42.04 H new ATOM 0 HB3 PRO A 95 57.589 -29.938 3.498 1.00 42.04 H new ATOM 0 HG2 PRO A 95 55.557 -28.118 4.776 1.00 43.34 H new ATOM 0 HG3 PRO A 95 57.154 -28.557 5.348 1.00 43.34 H new ATOM 0 HD2 PRO A 95 56.690 -26.181 4.100 1.00 14.11 H new ATOM 0 HD3 PRO A 95 58.229 -27.007 3.953 1.00 14.11 H new ATOM 1419 N ASP A 96 54.427 -30.004 1.556 1.00 24.01 N ATOM 1420 CA ASP A 96 53.031 -30.193 1.177 1.00 60.13 C ATOM 1421 C ASP A 96 52.309 -31.077 2.188 1.00 74.42 C ATOM 1422 O ASP A 96 51.133 -30.867 2.484 1.00 3.15 O ATOM 1423 CB ASP A 96 52.939 -30.812 -0.218 1.00 11.53 C ATOM 1424 CG ASP A 96 53.333 -29.838 -1.311 1.00 13.52 C ATOM 1425 OD1 ASP A 96 52.911 -28.665 -1.241 1.00 12.14 O ATOM 1426 OD2 ASP A 96 54.062 -30.249 -2.238 1.00 31.50 O ATOM 0 H ASP A 96 54.949 -30.870 1.689 1.00 24.01 H new ATOM 0 HA ASP A 96 52.547 -29.216 1.165 1.00 60.13 H new ATOM 0 HB2 ASP A 96 53.585 -31.689 -0.267 1.00 11.53 H new ATOM 0 HB3 ASP A 96 51.920 -31.157 -0.393 1.00 11.53 H new ATOM 1431 N ASP A 97 53.021 -32.068 2.715 1.00 33.03 N ATOM 1432 CA ASP A 97 52.448 -32.984 3.694 1.00 53.12 C ATOM 1433 C ASP A 97 53.458 -34.056 4.091 1.00 52.04 C ATOM 1434 O ASP A 97 53.899 -34.848 3.259 1.00 53.30 O ATOM 1435 CB ASP A 97 51.185 -33.640 3.132 1.00 72.14 C ATOM 1436 CG ASP A 97 50.786 -34.883 3.903 1.00 63.32 C ATOM 1437 OD1 ASP A 97 50.354 -34.746 5.066 1.00 2.52 O ATOM 1438 OD2 ASP A 97 50.908 -35.993 3.343 1.00 14.20 O ATOM 0 H ASP A 97 53.995 -32.257 2.480 1.00 33.03 H new ATOM 0 HA ASP A 97 52.186 -32.410 4.583 1.00 53.12 H new ATOM 0 HB2 ASP A 97 50.365 -32.922 3.156 1.00 72.14 H new ATOM 0 HB3 ASP A 97 51.349 -33.902 2.087 1.00 72.14 H new ATOM 1443 N GLY A 98 53.823 -34.074 5.370 1.00 60.13 N ATOM 1444 CA GLY A 98 54.780 -35.051 5.854 1.00 34.45 C ATOM 1445 C GLY A 98 56.203 -34.529 5.834 1.00 1.10 C ATOM 1446 O GLY A 98 57.134 -35.257 5.493 1.00 61.15 O ATOM 0 H GLY A 98 53.473 -33.429 6.079 1.00 60.13 H new ATOM 0 HA2 GLY A 98 54.517 -35.340 6.872 1.00 34.45 H new ATOM 0 HA3 GLY A 98 54.718 -35.950 5.241 1.00 34.45 H new ATOM 1450 N GLY A 99 56.372 -33.261 6.199 1.00 74.15 N ATOM 1451 CA GLY A 99 57.694 -32.664 6.212 1.00 63.35 C ATOM 1452 C GLY A 99 58.478 -32.962 4.948 1.00 31.04 C ATOM 1453 O GLY A 99 59.467 -33.695 4.981 1.00 2.15 O ATOM 0 H GLY A 99 55.617 -32.638 6.486 1.00 74.15 H new ATOM 0 HA2 GLY A 99 57.601 -31.585 6.332 1.00 63.35 H new ATOM 0 HA3 GLY A 99 58.248 -33.034 7.075 1.00 63.35 H new ATOM 1457 N SER A 100 58.035 -32.393 3.832 1.00 55.30 N ATOM 1458 CA SER A 100 58.699 -32.606 2.551 1.00 1.55 C ATOM 1459 C SER A 100 59.075 -31.276 1.906 1.00 2.05 C ATOM 1460 O SER A 100 58.471 -30.860 0.915 1.00 74.25 O ATOM 1461 CB SER A 100 57.793 -33.404 1.610 1.00 20.13 C ATOM 1462 OG SER A 100 58.014 -34.797 1.750 1.00 44.42 O ATOM 0 H SER A 100 57.220 -31.781 3.788 1.00 55.30 H new ATOM 0 HA SER A 100 59.612 -33.173 2.733 1.00 1.55 H new ATOM 0 HB2 SER A 100 56.749 -33.175 1.824 1.00 20.13 H new ATOM 0 HB3 SER A 100 57.980 -33.105 0.579 1.00 20.13 H new ATOM 0 HG SER A 100 57.423 -35.285 1.140 1.00 44.42 H new ATOM 1468 N CYS A 101 60.074 -30.612 2.475 1.00 24.41 N ATOM 1469 CA CYS A 101 60.531 -29.327 1.957 1.00 65.52 C ATOM 1470 C CYS A 101 61.866 -29.476 1.233 1.00 20.51 C ATOM 1471 O CYS A 101 62.672 -30.344 1.569 1.00 55.32 O ATOM 1472 CB CYS A 101 60.664 -28.313 3.094 1.00 62.33 C ATOM 1473 SG CYS A 101 59.985 -28.880 4.671 1.00 2.14 S ATOM 0 H CYS A 101 60.583 -30.942 3.295 1.00 24.41 H new ATOM 0 HA CYS A 101 59.790 -28.967 1.244 1.00 65.52 H new ATOM 0 HB2 CYS A 101 61.718 -28.072 3.230 1.00 62.33 H new ATOM 0 HB3 CYS A 101 60.161 -27.390 2.805 1.00 62.33 H new ATOM 0 HG CYS A 101 60.641 -29.928 5.074 1.00 2.14 H new ATOM 1479 N HIS A 102 62.092 -28.625 0.239 1.00 3.01 N ATOM 1480 CA HIS A 102 63.329 -28.662 -0.534 1.00 30.11 C ATOM 1481 C HIS A 102 63.552 -27.343 -1.267 1.00 31.51 C ATOM 1482 O HIS A 102 62.703 -26.899 -2.041 1.00 32.14 O ATOM 1483 CB HIS A 102 63.295 -29.817 -1.536 1.00 21.34 C ATOM 1484 CG HIS A 102 62.013 -29.902 -2.306 1.00 14.12 C ATOM 1485 ND1 HIS A 102 60.871 -30.488 -1.803 1.00 1.34 N ATOM 1486 CD2 HIS A 102 61.696 -29.471 -3.549 1.00 54.05 C ATOM 1487 CE1 HIS A 102 59.908 -30.416 -2.704 1.00 4.42 C ATOM 1488 NE2 HIS A 102 60.383 -29.802 -3.773 1.00 74.11 N ATOM 0 H HIS A 102 61.435 -27.901 -0.051 1.00 3.01 H new ATOM 0 HA HIS A 102 64.156 -28.816 0.159 1.00 30.11 H new ATOM 0 HB2 HIS A 102 64.123 -29.705 -2.236 1.00 21.34 H new ATOM 0 HB3 HIS A 102 63.452 -30.755 -1.003 1.00 21.34 H new ATOM 0 HD2 HIS A 102 62.354 -28.961 -4.237 1.00 54.05 H new ATOM 0 HE1 HIS A 102 58.903 -30.795 -2.587 1.00 4.42 H new ATOM 0 HE2 HIS A 102 59.859 -29.606 -4.626 1.00 74.11 H new ATOM 1496 N LEU A 103 64.699 -26.720 -1.018 1.00 52.23 N ATOM 1497 CA LEU A 103 65.034 -25.450 -1.654 1.00 73.15 C ATOM 1498 C LEU A 103 66.546 -25.277 -1.762 1.00 13.33 C ATOM 1499 O LEU A 103 67.297 -25.747 -0.907 1.00 24.05 O ATOM 1500 CB LEU A 103 64.431 -24.287 -0.864 1.00 1.03 C ATOM 1501 CG LEU A 103 64.292 -22.965 -1.618 1.00 65.50 C ATOM 1502 CD1 LEU A 103 65.643 -22.275 -1.740 1.00 61.24 C ATOM 1503 CD2 LEU A 103 63.684 -23.196 -2.994 1.00 23.43 C ATOM 0 H LEU A 103 65.413 -27.073 -0.380 1.00 52.23 H new ATOM 0 HA LEU A 103 64.615 -25.454 -2.660 1.00 73.15 H new ATOM 0 HB2 LEU A 103 63.444 -24.587 -0.511 1.00 1.03 H new ATOM 0 HB3 LEU A 103 65.047 -24.116 0.019 1.00 1.03 H new ATOM 0 HG LEU A 103 63.624 -22.315 -1.052 1.00 65.50 H new ATOM 0 HD11 LEU A 103 65.524 -21.335 -2.280 1.00 61.24 H new ATOM 0 HD12 LEU A 103 66.040 -22.074 -0.745 1.00 61.24 H new ATOM 0 HD13 LEU A 103 66.334 -22.920 -2.283 1.00 61.24 H new ATOM 0 HD21 LEU A 103 63.593 -22.243 -3.516 1.00 23.43 H new ATOM 0 HD22 LEU A 103 64.326 -23.864 -3.568 1.00 23.43 H new ATOM 0 HD23 LEU A 103 62.697 -23.646 -2.885 1.00 23.43 H new ATOM 1515 N TRP A 104 66.984 -24.600 -2.816 1.00 51.55 N ATOM 1516 CA TRP A 104 68.407 -24.364 -3.035 1.00 22.54 C ATOM 1517 C TRP A 104 68.992 -23.498 -1.924 1.00 12.03 C ATOM 1518 O TRP A 104 68.590 -22.347 -1.744 1.00 35.42 O ATOM 1519 CB TRP A 104 68.630 -23.694 -4.392 1.00 61.54 C ATOM 1520 CG TRP A 104 67.733 -22.517 -4.629 1.00 74.21 C ATOM 1521 CD1 TRP A 104 67.968 -21.221 -4.268 1.00 54.34 C ATOM 1522 CD2 TRP A 104 66.457 -22.531 -5.278 1.00 64.32 C ATOM 1523 NE1 TRP A 104 66.915 -20.428 -4.653 1.00 44.30 N ATOM 1524 CE2 TRP A 104 65.975 -21.206 -5.276 1.00 51.42 C ATOM 1525 CE3 TRP A 104 65.676 -23.531 -5.863 1.00 24.31 C ATOM 1526 CZ2 TRP A 104 64.747 -20.861 -5.835 1.00 70.53 C ATOM 1527 CZ3 TRP A 104 64.457 -23.186 -6.417 1.00 21.20 C ATOM 1528 CH2 TRP A 104 64.004 -21.860 -6.400 1.00 10.01 C ATOM 0 H TRP A 104 66.375 -24.205 -3.533 1.00 51.55 H new ATOM 0 HA TRP A 104 68.916 -25.328 -3.025 1.00 22.54 H new ATOM 0 HB2 TRP A 104 69.668 -23.370 -4.463 1.00 61.54 H new ATOM 0 HB3 TRP A 104 68.470 -24.428 -5.182 1.00 61.54 H new ATOM 0 HD1 TRP A 104 68.852 -20.871 -3.755 1.00 54.34 H new ATOM 0 HE1 TRP A 104 66.844 -19.422 -4.500 1.00 44.30 H new ATOM 0 HE3 TRP A 104 66.018 -24.555 -5.882 1.00 24.31 H new ATOM 0 HZ2 TRP A 104 64.394 -19.840 -5.823 1.00 70.53 H new ATOM 0 HZ3 TRP A 104 63.844 -23.951 -6.870 1.00 21.20 H new ATOM 0 HH2 TRP A 104 63.048 -21.622 -6.842 1.00 10.01 H new ATOM 1539 N LEU A 105 69.940 -24.056 -1.182 1.00 71.44 N ATOM 1540 CA LEU A 105 70.581 -23.335 -0.088 1.00 30.14 C ATOM 1541 C LEU A 105 71.867 -22.663 -0.558 1.00 24.24 C ATOM 1542 O LEU A 105 72.410 -23.005 -1.608 1.00 21.51 O ATOM 1543 CB LEU A 105 70.884 -24.288 1.070 1.00 50.12 C ATOM 1544 CG LEU A 105 71.041 -25.763 0.701 1.00 11.34 C ATOM 1545 CD1 LEU A 105 72.240 -25.961 -0.212 1.00 51.43 C ATOM 1546 CD2 LEU A 105 71.177 -26.615 1.955 1.00 13.32 C ATOM 0 H LEU A 105 70.283 -25.007 -1.318 1.00 71.44 H new ATOM 0 HA LEU A 105 69.894 -22.562 0.256 1.00 30.14 H new ATOM 0 HB2 LEU A 105 71.801 -23.956 1.557 1.00 50.12 H new ATOM 0 HB3 LEU A 105 70.084 -24.201 1.805 1.00 50.12 H new ATOM 0 HG LEU A 105 70.146 -26.080 0.165 1.00 11.34 H new ATOM 0 HD11 LEU A 105 72.335 -27.017 -0.464 1.00 51.43 H new ATOM 0 HD12 LEU A 105 72.102 -25.382 -1.125 1.00 51.43 H new ATOM 0 HD13 LEU A 105 73.144 -25.626 0.297 1.00 51.43 H new ATOM 0 HD21 LEU A 105 71.288 -27.662 1.673 1.00 13.32 H new ATOM 0 HD22 LEU A 105 72.054 -26.296 2.518 1.00 13.32 H new ATOM 0 HD23 LEU A 105 70.287 -26.498 2.573 1.00 13.32 H new ATOM 1558 N GLY A 106 72.349 -21.705 0.228 1.00 61.33 N ATOM 1559 CA GLY A 106 73.570 -21.001 -0.124 1.00 51.43 C ATOM 1560 C GLY A 106 74.810 -21.688 0.412 1.00 0.03 C ATOM 1561 O GLY A 106 74.732 -22.484 1.348 1.00 42.24 O ATOM 0 H GLY A 106 71.917 -21.404 1.101 1.00 61.33 H new ATOM 0 HA2 GLY A 106 73.641 -20.924 -1.209 1.00 51.43 H new ATOM 0 HA3 GLY A 106 73.525 -19.984 0.266 1.00 51.43 H new ATOM 1565 N ARG A 107 75.958 -21.381 -0.183 1.00 62.13 N ATOM 1566 CA ARG A 107 77.220 -21.976 0.238 1.00 61.52 C ATOM 1567 C ARG A 107 77.600 -21.510 1.641 1.00 74.10 C ATOM 1568 O ARG A 107 77.148 -20.462 2.102 1.00 51.43 O ATOM 1569 CB ARG A 107 78.333 -21.617 -0.748 1.00 52.34 C ATOM 1570 CG ARG A 107 78.931 -20.240 -0.516 1.00 5.34 C ATOM 1571 CD ARG A 107 79.212 -19.527 -1.830 1.00 21.31 C ATOM 1572 NE ARG A 107 78.065 -18.748 -2.287 1.00 13.22 N ATOM 1573 CZ ARG A 107 77.915 -18.324 -3.537 1.00 52.32 C ATOM 1574 NH1 ARG A 107 78.835 -18.603 -4.450 1.00 74.13 N ATOM 1575 NH2 ARG A 107 76.842 -17.621 -3.877 1.00 34.32 N ATOM 0 H ARG A 107 76.040 -20.723 -0.958 1.00 62.13 H new ATOM 0 HA ARG A 107 77.094 -23.059 0.254 1.00 61.52 H new ATOM 0 HB2 ARG A 107 79.124 -22.364 -0.678 1.00 52.34 H new ATOM 0 HB3 ARG A 107 77.938 -21.666 -1.763 1.00 52.34 H new ATOM 0 HG2 ARG A 107 78.247 -19.641 0.085 1.00 5.34 H new ATOM 0 HG3 ARG A 107 79.856 -20.335 0.053 1.00 5.34 H new ATOM 0 HD2 ARG A 107 80.072 -18.868 -1.708 1.00 21.31 H new ATOM 0 HD3 ARG A 107 79.478 -20.261 -2.591 1.00 21.31 H new ATOM 0 HE ARG A 107 77.339 -18.517 -1.609 1.00 13.22 H new ATOM 0 HH11 ARG A 107 79.660 -19.144 -4.193 1.00 74.13 H new ATOM 0 HH12 ARG A 107 78.717 -18.276 -5.409 1.00 74.13 H new ATOM 0 HH21 ARG A 107 76.131 -17.405 -3.178 1.00 34.32 H new ATOM 0 HH22 ARG A 107 76.728 -17.296 -4.837 1.00 34.32 H new ATOM 1589 N GLY A 108 78.433 -22.297 2.315 1.00 33.03 N ATOM 1590 CA GLY A 108 78.858 -21.949 3.659 1.00 42.40 C ATOM 1591 C GLY A 108 79.930 -22.881 4.187 1.00 33.35 C ATOM 1592 O GLY A 108 79.670 -24.057 4.442 1.00 32.33 O ATOM 0 H GLY A 108 78.821 -23.169 1.955 1.00 33.03 H new ATOM 0 HA2 GLY A 108 79.235 -20.926 3.664 1.00 42.40 H new ATOM 0 HA3 GLY A 108 77.997 -21.975 4.327 1.00 42.40 H new ATOM 1596 N VAL A 109 81.141 -22.356 4.350 1.00 11.34 N ATOM 1597 CA VAL A 109 82.257 -23.149 4.851 1.00 52.32 C ATOM 1598 C VAL A 109 82.288 -23.154 6.376 1.00 42.44 C ATOM 1599 O VAL A 109 82.149 -22.118 7.027 1.00 12.50 O ATOM 1600 CB VAL A 109 83.603 -22.620 4.323 1.00 64.24 C ATOM 1601 CG1 VAL A 109 83.797 -21.164 4.720 1.00 64.44 C ATOM 1602 CG2 VAL A 109 84.751 -23.477 4.834 1.00 31.11 C ATOM 0 H VAL A 109 81.374 -21.385 4.142 1.00 11.34 H new ATOM 0 HA VAL A 109 82.108 -24.167 4.491 1.00 52.32 H new ATOM 0 HB VAL A 109 83.594 -22.678 3.235 1.00 64.24 H new ATOM 0 HG11 VAL A 109 84.754 -20.807 4.338 1.00 64.44 H new ATOM 0 HG12 VAL A 109 82.991 -20.562 4.300 1.00 64.44 H new ATOM 0 HG13 VAL A 109 83.785 -21.078 5.807 1.00 64.44 H new ATOM 0 HG21 VAL A 109 85.694 -23.088 4.450 1.00 31.11 H new ATOM 0 HG22 VAL A 109 84.765 -23.454 5.924 1.00 31.11 H new ATOM 0 HG23 VAL A 109 84.617 -24.504 4.495 1.00 31.11 H new ATOM 1612 N PRO A 110 82.475 -24.347 6.959 1.00 21.04 N ATOM 1613 CA PRO A 110 82.529 -24.516 8.414 1.00 32.04 C ATOM 1614 C PRO A 110 83.790 -23.911 9.021 1.00 21.42 C ATOM 1615 O PRO A 110 84.739 -23.560 8.319 1.00 25.33 O ATOM 1616 CB PRO A 110 82.524 -26.036 8.596 1.00 2.21 C ATOM 1617 CG PRO A 110 83.088 -26.571 7.325 1.00 64.35 C ATOM 1618 CD PRO A 110 82.647 -25.622 6.244 1.00 72.32 C ATOM 0 HA PRO A 110 81.702 -24.011 8.914 1.00 32.04 H new ATOM 0 HB2 PRO A 110 83.127 -26.334 9.453 1.00 2.21 H new ATOM 0 HB3 PRO A 110 81.515 -26.411 8.770 1.00 2.21 H new ATOM 0 HG2 PRO A 110 84.175 -26.628 7.374 1.00 64.35 H new ATOM 0 HG3 PRO A 110 82.724 -27.580 7.131 1.00 64.35 H new ATOM 0 HD2 PRO A 110 83.391 -25.541 5.452 1.00 72.32 H new ATOM 0 HD3 PRO A 110 81.718 -25.949 5.776 1.00 72.32 H new ATOM 1626 N PRO A 111 83.805 -23.787 10.357 1.00 3.33 N ATOM 1627 CA PRO A 111 84.945 -23.225 11.087 1.00 31.20 C ATOM 1628 C PRO A 111 86.160 -24.146 11.061 1.00 31.35 C ATOM 1629 O PRO A 111 87.283 -23.716 11.324 1.00 32.15 O ATOM 1630 CB PRO A 111 84.414 -23.080 12.515 1.00 13.14 C ATOM 1631 CG PRO A 111 83.331 -24.097 12.622 1.00 14.15 C ATOM 1632 CD PRO A 111 82.709 -24.186 11.257 1.00 45.44 C ATOM 0 HA PRO A 111 85.289 -22.288 10.648 1.00 31.20 H new ATOM 0 HB2 PRO A 111 85.199 -23.259 13.249 1.00 13.14 H new ATOM 0 HB3 PRO A 111 84.032 -22.075 12.695 1.00 13.14 H new ATOM 0 HG2 PRO A 111 83.732 -25.062 12.932 1.00 14.15 H new ATOM 0 HG3 PRO A 111 82.593 -23.804 13.369 1.00 14.15 H new ATOM 0 HD2 PRO A 111 82.358 -25.195 11.040 1.00 45.44 H new ATOM 0 HD3 PRO A 111 81.850 -23.522 11.163 1.00 45.44 H new ATOM 1640 N ALA A 112 85.928 -25.415 10.743 1.00 74.42 N ATOM 1641 CA ALA A 112 87.004 -26.396 10.682 1.00 73.14 C ATOM 1642 C ALA A 112 87.841 -26.214 9.420 1.00 23.44 C ATOM 1643 O ALA A 112 87.307 -25.975 8.337 1.00 2.12 O ATOM 1644 CB ALA A 112 86.437 -27.808 10.741 1.00 24.14 C ATOM 0 H ALA A 112 85.004 -25.788 10.524 1.00 74.42 H new ATOM 0 HA ALA A 112 87.653 -26.240 11.544 1.00 73.14 H new ATOM 0 HB1 ALA A 112 87.252 -28.530 10.694 1.00 24.14 H new ATOM 0 HB2 ALA A 112 85.888 -27.941 11.673 1.00 24.14 H new ATOM 0 HB3 ALA A 112 85.764 -27.966 9.898 1.00 24.14 H new ATOM 1650 N VAL A 113 89.157 -26.328 9.567 1.00 64.43 N ATOM 1651 CA VAL A 113 90.069 -26.175 8.439 1.00 74.33 C ATOM 1652 C VAL A 113 90.973 -27.395 8.294 1.00 10.22 C ATOM 1653 O VAL A 113 91.461 -27.939 9.283 1.00 11.00 O ATOM 1654 CB VAL A 113 90.944 -24.917 8.591 1.00 3.32 C ATOM 1655 CG1 VAL A 113 91.774 -24.994 9.862 1.00 20.54 C ATOM 1656 CG2 VAL A 113 91.837 -24.740 7.371 1.00 31.44 C ATOM 0 H VAL A 113 89.616 -26.526 10.456 1.00 64.43 H new ATOM 0 HA VAL A 113 89.453 -26.074 7.545 1.00 74.33 H new ATOM 0 HB VAL A 113 90.291 -24.048 8.665 1.00 3.32 H new ATOM 0 HG11 VAL A 113 92.386 -24.096 9.952 1.00 20.54 H new ATOM 0 HG12 VAL A 113 91.112 -25.070 10.725 1.00 20.54 H new ATOM 0 HG13 VAL A 113 92.420 -25.871 9.822 1.00 20.54 H new ATOM 0 HG21 VAL A 113 92.449 -23.846 7.495 1.00 31.44 H new ATOM 0 HG22 VAL A 113 92.484 -25.611 7.264 1.00 31.44 H new ATOM 0 HG23 VAL A 113 91.219 -24.636 6.479 1.00 31.44 H new ATOM 1666 N ASN A 114 91.191 -27.819 7.053 1.00 4.01 N ATOM 1667 CA ASN A 114 92.036 -28.974 6.777 1.00 32.34 C ATOM 1668 C ASN A 114 93.368 -28.543 6.171 1.00 23.35 C ATOM 1669 O ASN A 114 93.403 -27.875 5.137 1.00 23.41 O ATOM 1670 CB ASN A 114 91.322 -29.941 5.831 1.00 4.35 C ATOM 1671 CG ASN A 114 92.241 -31.031 5.316 1.00 52.32 C ATOM 1672 OD1 ASN A 114 93.176 -31.445 6.000 1.00 65.51 O ATOM 1673 ND2 ASN A 114 91.978 -31.501 4.101 1.00 33.54 N ATOM 0 H ASN A 114 90.794 -27.379 6.223 1.00 4.01 H new ATOM 0 HA ASN A 114 92.234 -29.480 7.722 1.00 32.34 H new ATOM 0 HB2 ASN A 114 90.478 -30.396 6.350 1.00 4.35 H new ATOM 0 HB3 ASN A 114 90.914 -29.385 4.987 1.00 4.35 H new ATOM 0 HD21 ASN A 114 92.562 -32.235 3.700 1.00 33.54 H new ATOM 0 HD22 ASN A 114 91.192 -31.128 3.569 1.00 33.54 H new ATOM 1680 N ARG A 115 94.461 -28.928 6.822 1.00 53.31 N ATOM 1681 CA ARG A 115 95.795 -28.581 6.347 1.00 11.11 C ATOM 1682 C ARG A 115 96.503 -29.803 5.770 1.00 14.15 C ATOM 1683 O ARG A 115 96.393 -30.906 6.305 1.00 14.30 O ATOM 1684 CB ARG A 115 96.626 -27.988 7.486 1.00 31.30 C ATOM 1685 CG ARG A 115 97.046 -29.010 8.530 1.00 1.30 C ATOM 1686 CD ARG A 115 97.152 -28.384 9.912 1.00 23.30 C ATOM 1687 NE ARG A 115 98.496 -27.881 10.182 1.00 22.43 N ATOM 1688 CZ ARG A 115 98.806 -27.146 11.245 1.00 72.02 C ATOM 1689 NH1 ARG A 115 97.873 -26.830 12.132 1.00 40.15 N ATOM 1690 NH2 ARG A 115 100.052 -26.726 11.422 1.00 72.25 N ATOM 0 H ARG A 115 94.449 -29.480 7.680 1.00 53.31 H new ATOM 0 HA ARG A 115 95.690 -27.838 5.557 1.00 11.11 H new ATOM 0 HB2 ARG A 115 97.518 -27.520 7.068 1.00 31.30 H new ATOM 0 HB3 ARG A 115 96.051 -27.200 7.972 1.00 31.30 H new ATOM 0 HG2 ARG A 115 96.323 -29.826 8.553 1.00 1.30 H new ATOM 0 HG3 ARG A 115 98.007 -29.443 8.251 1.00 1.30 H new ATOM 0 HD2 ARG A 115 96.435 -27.567 9.996 1.00 23.30 H new ATOM 0 HD3 ARG A 115 96.883 -29.123 10.667 1.00 23.30 H new ATOM 0 HE ARG A 115 99.237 -28.106 9.519 1.00 22.43 H new ATOM 0 HH11 ARG A 115 96.914 -27.151 12.000 1.00 40.15 H new ATOM 0 HH12 ARG A 115 98.114 -26.266 12.947 1.00 40.15 H new ATOM 0 HH21 ARG A 115 100.773 -26.967 10.742 1.00 72.25 H new ATOM 0 HH22 ARG A 115 100.289 -26.162 12.238 1.00 72.25 H new ATOM 1704 N ARG A 116 97.228 -29.599 4.675 1.00 20.03 N ATOM 1705 CA ARG A 116 97.951 -30.684 4.025 1.00 75.23 C ATOM 1706 C ARG A 116 99.459 -30.460 4.108 1.00 32.14 C ATOM 1707 O ARG A 116 99.945 -29.353 3.877 1.00 71.23 O ATOM 1708 CB ARG A 116 97.524 -30.805 2.561 1.00 55.25 C ATOM 1709 CG ARG A 116 96.528 -31.926 2.308 1.00 22.20 C ATOM 1710 CD ARG A 116 97.146 -33.290 2.570 1.00 73.02 C ATOM 1711 NE ARG A 116 96.655 -34.303 1.639 1.00 4.44 N ATOM 1712 CZ ARG A 116 96.974 -34.333 0.350 1.00 3.31 C ATOM 1713 NH1 ARG A 116 97.781 -33.411 -0.158 1.00 50.32 N ATOM 1714 NH2 ARG A 116 96.486 -35.285 -0.433 1.00 52.34 N ATOM 0 H ARG A 116 97.330 -28.692 4.220 1.00 20.03 H new ATOM 0 HA ARG A 116 97.709 -31.611 4.546 1.00 75.23 H new ATOM 0 HB2 ARG A 116 97.085 -29.861 2.240 1.00 55.25 H new ATOM 0 HB3 ARG A 116 98.408 -30.970 1.946 1.00 55.25 H new ATOM 0 HG2 ARG A 116 95.656 -31.791 2.949 1.00 22.20 H new ATOM 0 HG3 ARG A 116 96.177 -31.876 1.277 1.00 22.20 H new ATOM 0 HD2 ARG A 116 98.231 -33.218 2.488 1.00 73.02 H new ATOM 0 HD3 ARG A 116 96.923 -33.598 3.591 1.00 73.02 H new ATOM 0 HE ARG A 116 96.033 -35.027 1.999 1.00 4.44 H new ATOM 0 HH11 ARG A 116 98.158 -32.677 0.442 1.00 50.32 H new ATOM 0 HH12 ARG A 116 98.025 -33.436 -1.148 1.00 50.32 H new ATOM 0 HH21 ARG A 116 95.865 -35.995 -0.046 1.00 52.34 H new ATOM 0 HH22 ARG A 116 96.732 -35.307 -1.423 1.00 52.34 H new ATOM 1728 N ARG A 117 100.191 -31.518 4.442 1.00 41.42 N ATOM 1729 CA ARG A 117 101.641 -31.436 4.558 1.00 65.34 C ATOM 1730 C ARG A 117 102.270 -31.015 3.233 1.00 21.51 C ATOM 1731 O ARG A 117 102.768 -29.896 3.099 1.00 31.21 O ATOM 1732 CB ARG A 117 102.216 -32.783 5.002 1.00 70.55 C ATOM 1733 CG ARG A 117 103.510 -32.663 5.791 1.00 0.40 C ATOM 1734 CD ARG A 117 104.718 -32.582 4.870 1.00 2.03 C ATOM 1735 NE ARG A 117 105.073 -33.885 4.316 1.00 61.15 N ATOM 1736 CZ ARG A 117 105.819 -34.043 3.227 1.00 35.12 C ATOM 1737 NH1 ARG A 117 106.286 -32.984 2.581 1.00 10.41 N ATOM 1738 NH2 ARG A 117 106.098 -35.262 2.785 1.00 63.43 N ATOM 0 H ARG A 117 99.803 -32.441 4.637 1.00 41.42 H new ATOM 0 HA ARG A 117 101.878 -30.682 5.309 1.00 65.34 H new ATOM 0 HB2 ARG A 117 101.476 -33.301 5.611 1.00 70.55 H new ATOM 0 HB3 ARG A 117 102.393 -33.401 4.122 1.00 70.55 H new ATOM 0 HG2 ARG A 117 103.472 -31.775 6.422 1.00 0.40 H new ATOM 0 HG3 ARG A 117 103.614 -33.521 6.455 1.00 0.40 H new ATOM 0 HD2 ARG A 117 104.508 -31.888 4.057 1.00 2.03 H new ATOM 0 HD3 ARG A 117 105.568 -32.179 5.421 1.00 2.03 H new ATOM 0 HE ARG A 117 104.730 -34.720 4.790 1.00 61.15 H new ATOM 0 HH11 ARG A 117 106.073 -32.046 2.919 1.00 10.41 H new ATOM 0 HH12 ARG A 117 106.858 -33.108 1.746 1.00 10.41 H new ATOM 0 HH21 ARG A 117 105.740 -36.079 3.281 1.00 63.43 H new ATOM 0 HH22 ARG A 117 106.670 -35.383 1.949 1.00 63.43 H new TER 1752 ARG A 117